Clotrimazole
CAS Number: 23593-75-1
Molecular Mass: 344.8 g/mol
Formula: C22H17ClN2
Smiles: Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1
Synonymes:
Clotrimazole, clotrimazole, 23593-75-1, Lotrimin, Canesten, Mycelex, Mycosporin, Clotrimazol, Empecid, Mykosporin, Gyne lotrimin, Chlotrimazole, Trimysten, Gyne-Lotrimin, Mycelex G, Rimazole, Tibatin, Gynix, Mono-baycuten, Mycelex Troches, 1-(o-Chlorotrityl)imidazole, 1-((2-Chlorophenyl)diphenylmethyl)-1H-imidazole, Pedisafe, Veltrim, Trivagizole 3, Desamix F, Mycelex-G, Clotrimazolum, Gyne-Lotrimin 3, Monobaycuten, Mycelex-7, Canifug, (Chlorotrityl)imidazole, BAY 5097, Mycelex-7 Combination Pack, Gyne-Lotrimin Combination Pack, Gyne-Lotrimin 3 Combination Pack, Bay-B 5097, Trivagizole, 1-(o-Chloro-alpha,alpha-diphenylbenzyl)imidazole, Jidesheng, 1-[(2-Chlorophenyl)diphenylmethyl]-1H-imidazole, (2-Chlorophenyl)diphenyl-1-imidazolylmethane, 1H-Imidazole, 1-[(2-chlorophenyl)diphenylmethyl]-, Diphenyl-(2-chlorophenyl)-1-imidazolylmethane, FB 5097, 1-(alpha-(2-Chlorophenyl)benzhydryl)imidazole, 1-[(2-chlorophenyl)-diphenylmethyl]imidazole, GNF-Pf-3499, B 5097, BAY-5097, NSC257473, NSC-257473, 1-[(2-chlorophenyl)(diphenyl)methyl]-1H-imidazole, DTXSID7029871, 1H-Imidazole, 1-((2-chlorophenyl)diphenylmethyl)-, G07GZ97H65, SVT-15652, CHEBI:3764, DTXCID009871, Klotrimazole, Kanesten, 1-((2-chlorophenyl)-diphenylmethyl)imidazole, 1-((2-chlorophenyl)-di(phenyl)methyl)imidazole, 1-[(2-chlorophenyl)-di(phenyl)methyl]imidazole, 1-((2-chlorophenyl)(diphenyl)methyl)-1H-imidazole, clotrimazolo, Coltrimazole, Actavall, Alevazol, Candiden, Careone, Fortinia, Fungederm, Fungicure, Lakesia, Masnoderm, Occulus, Pedesil, Privacom, Ringworm, Trimazole, Abtrim, TheraPlus, UpandUp, Antifungal Soap, Canesten af, Canesten vc, Heb Antifungal, Mycelex Troche, Signature Care, Theraplus Plus, Clotrima Top, Fungistat Max, Mycil gold, TM-Clotrimazole, Cura Hongo, Cura Hongos, Skin Repair, Canesten internal, Athlete s Foot, Fortinia OF, Micotrin AC, Clotrimazole 1%, CVS Clotrimazole, Mycozyl AC, ringworm treatment, Equate Jock Itch, Kroger Jock Itch, Rexall Jock Itch, Target Jock Itch, Drs. Clotrimazole, Dynarex Antifungal, Fungazoil Advanced, Major Clotrimazole, Anti-Fungal Cream, Canesten crm combi, Dermatin Antifungal, Fungicure Intensive, Shoprite Antifungal, Clotrimazole topical, Hua Tuo Xian Gao, Aspiera Anti-fungal, Aardora Anti-Fungal, Careone Clotrimazole, Upandup Clotrimazole, Walgreens Jock Itch, Zapotol Clotrimazole, APTRIMAZOLE, Fungicure Liquid Gel, Jock Itch Antifungal, Kroger Athletes Foot, Meijer Athletes Foot, Publix Athletic Foot, Rexall Athletes Foot, Clotrimazole 1.0%, Pro-EX Anti Fungal, Athlete S Foot Afac, CAREALL Clotrimazole, Cura Hongo Antifungal, PerfectHeal Antifungal, Walgreens Clotrimazole, Meijer Clotrimazole 3, CANESTEN V, Clotrimazole Antifungal, Clotrimazole Jock Itch, Cura Hongos Antifungal, CLOTRIMAZOL DUAL, JOCK-EZE, WinCo Foods Antifungal, Clotrimazole Cream 1%, Cvs Antifungal Ringworm, RefChem:5700, Sunmark Clotrimazole 3, Topcare Clotrimazole 3, footlogix intensive care, PRO-EX, AKIN ANTI-FUNGAL, up and up athletes foot, Best Choice Clotrimazole, Pedesil Maximum Strength, Terrasil Tinea Treatment, Astonea Clotrimazole 1%, Clotrimazole Cream, 1%, TerrasilMed ANTIFUNGAL, Walgreens Clotrimazole 3, terrasil Fungal Treatment, Our Family Athletes Foot, Signature Care Jock Itch, Clotrimazole Athletes Foot, Healthy Accents Antifungal, SUNMARK CLOTRIMAZOLE, Dr Sheffield Athletes Foot, Quality Choice Clotrimazole, Terrasil Ringworm Treatment, Family Wellness Clotrimazole, Forticept Antifungal Cooling, Cvs Pharmacy Clotrimazole 3, Quality Choice Athletes Foot, Rite Aid Antifungal Ringworm, Terrasil Tinea Treatment Max, Western Family Athletes Foot, Forticept Antifungal Foot Gel, Lucky Supersoft Athletes Foot, Budpak Antifungal Clotrimazole, GOODSENSE ATHLETES FOOT, Fastrin Anti-Fungal Skin Care, lmnoop serious antifungal cream, Smooth Gator Fungus Eliminator, Terrasil Anti-fungal Treatment, Atopalm Clotrimazole Antifungal, AU KAH CHUEN ANTIFUNGAL, Clotrimazole 1% Athletes Foot, Clotrimazole Transdermal Liquid, Meijer Athletes Foot Cream AF, Veltrim 1% Dermatologic Cream, Forticept Antifungal Foot Cream, Leader Clotrimazole Anti-fungal, Terrasil Ringworm Treatment Max, Clotrimazole, Thuja Occidentalis, SIMPLY VITAL Antifungal Cream, Soundbody Clotrimazole Antifungal, Terrasil Rapid-clear Anti-fungal, terrasil The Fungal Solution Kit, Walgreens Clotrimazole Antifungal, A01AB18, Antifungal 1% Clotrimazole Cream, Blossom Pharmaceuticals Antifungal, Clotrimazole 1% Antifungal Cream, D01AC01, G01AF02, Jock Itch Clotrimazole Antifungal, Terrasil Antifungal Cleansing Bar, CVS Clotrimazole Maximum Strength, Jock Itch Cream with Clotrimazole, Thera plus Antifungal Clotrimazole, Athletes Foot Antifungal Antifungal, Good Neighbor Pharmacy Clotrimazole, HUA TUO XIAN GAO ANTIFUNGAL, Rugby Clotrimazole Antifungal Cream, Terrasil Anti-fungal Treatment Max, Terrasil Foot and Nail Anti-fungal, Aptrimazole 1.0% Antifungal Cream, Cvs Pharmacy Itch Relief Antifungal, First Aid Research Antifungal .5oz, RUGBY ANTIFUNGAL CLOTRIMAZOLE, Aardora Anti-Fungal Maximum Strength, Athlete Foot Cream with Clotrimazole, Terrasil SERIOUS TINEA TREATMENT, Clotrimazole (Topical Solution), 1%, Terrasil SERIOUS FUNGAL TREATMENT, Astonea Clotrimazole 1% Athletes Foot, Fungicure Manicure Pedicure Liquid Gel, Good Neighbor Pharmacy Clotrimazole 3, WELMATE Clotrimazole Topical Solution, 1MED Clotrimazole 1% Antifungal Cream, Clotrimazole Topical Solution USP, 1%, LEADER ATHLETES FOOT CLOTRIMAZOLE, Clotrimazole 1% Topical Antifungal Cream, First Aid Research Antifungal Cream 1oz, RoyceDerm Tea Tree Oil Antifungal Soap., Footlogix Intensive Care Diabetic Formula, Occulus Skin Hydrating Topical Foam Clo-1, Terrasil Antifungal Cream Maximum Strength, Terrasil JockItch Treatment Maximum Strength, Botanimedix TineaRX Antifungal Drying Emulsion, Terrasil Jock Itch Treatment Maximum Strength, Terrasil Athletes Foot AntiFungal Treatment Max, Family Wellness Clotrimazole 1 Anti Fungal Cream, Terrasil Foot and Nail Anti-fungal Maximum Strength, Occulus Skin Hydrating Topical Foam Clo-1 Antifungal Foam, 245-764-8, Dermatin, Mycelex 7, Lotrimin AF Cream, Mycelex OTC, Canestine, Lotrimin Af, Fem Care, BAY b 5097, Lotrimax, Lotrimin AF Jock-Itch Cream, Mycelax, Mycofug, Lotrimin (TN), Mycelex (TN), 1-(o-Chlorophenyldiphenylmethyl)imidazole, Diphenyl(2-chlorophenyl)(1-imidazolyl)methane, NSC 257473, Mycelex: MycosporinRimazole, Bay b 9057, MFCD00057220, Prestwick_120, Bis-phenyl-(2-chlorophenyl)(1-imidazoyl)methane, Methane, bis-phenyl-(2-chlorophenyl)-1-imidazolyl-, 1-[(2-chlorophenyl)-diphenyl-methyl]imidazole, Bisphenyl-(2-chlorphenyl)-1-imidazolyl-methan, Lopac-C-6019, CHEMBL104, 1-(2-chlorotrityl)imidazole, MLS000028502, 1-(o-Chloro-.alpha.,.alpha.-diphenylbenzyl)imidazole, NCGC00015251-02, Clotrimaderm, Canestene, Clomatin, Cutistad, Esparol, SMR000058306, Stiemazol, Nalbix, FemCare, Lotrimin Lotion, Canesten Cream, CAS-23593-75-1, Gino-Lotremine, Lotrimin Cream, Mycelex Cream, Myclo Cream, Myclo-Gyne, Pan-Fungex, Neo-Zol Cream, Bis-phenyl-(2-chlorophenyl)-1-imidazoyl)methane, Mycelex Twin Pack, Lotrimin AF Lotion, Clotrimazol [INN-Spanish], Clotrimazolum [INN-Latin], clotrimeizol, Canesten 1-Day Therapy, Canesten 3-Day Therapy, Canesten 6-Day Therapy, DRG-0072, CCRIS 6245, Canesten 1-Day Cream Combi-Pak, HSDB 3266, Canesten Combi-Pak 1-Day Therapy, Canesten Combi-Pak 3-Day Therapy, SR-01000075771, EINECS 245-764-8, BRN 0622318, chlortrimazole, clortrimazole, Otomax, UNII-G07GZ97H65, 1-((o-Chloro-phenyl)diphenylmethyl)imidazole, Gyne-Lotrimin3, Bis-fenil-(2-clorofenil)-1-imidazolil-metano, Clotrimazole CRS, Clotrimaderm Cream, CLOTIC, Bis-fenil-(2-clorofenil)-1-imidazolil-metano [Italian], Bisphenyl-(2-chlorphenyl)-1-imidazolyl-methan [German], FB-5097, Clotrimazole [USAN:USP:INN:BAN:JAN], Spectrum_001343, CPD000058306, Clotrimazole (Canesten), Clotrimazole (Standard), Prestwick0_000267, Prestwick1_000267, Prestwick2_000267, Prestwick3_000267, Spectrum2_000128, Spectrum3_000359, Spectrum4_000295, Spectrum5_000781, CLOTRIMAZOLE [MI], CLOTRIMAZOLE [INN], CLOTRIMAZOLE [JAN], C 6019, CLOTRIMAZOLE [USAN], NCIMech_000609, cid_2812, SCHEMBL3850, CLOTRIMAZOLE [VANDF], BIDD:PXR0036, Lopac0_000315, BSPBio_000114, BSPBio_002057, CLOTRIMAZOLE [MART.], KBioGR_000850, KBioSS_001823, 5-23-04-00291 (Beilstein Handbook Reference), MLS000758243, MLS001423972, BIDD:GT0450, CLOTRIMAZOLE [USP-RS], CLOTRIMAZOLE [WHO-DD], DivK1c_000665, SPECTRUM1500200, BAY b5097, BAYb 5097, Imidazole, 1-(o-chloro-alpha,alpha-diphenylbenzyl)-, SPBio_000176, SPBio_002333, BPBio1_000126, GTPL2330, orb1310546, orb3025746, component of Otomax (Salt/Mix), Gyne-Lotrimin3 Combination Pack, SCHEMBL29358270, BDBM31774, Clotrimazole (JP18/USP/INN), HMS502B07, KBio1_000665, KBio2_001823, KBio2_004391, KBio2_006959, KBio3_001277, CLOTRIMAZOLE [GREEN BOOK], Imidazole, 1-(o-chloro-.alpha.,.alpha.-diphenylbenzyl)-, component of Lotrimax (Salt/Mix), NINDS_000665, CLOTRIMAZOLE [EP IMPURITY], CLOTRIMAZOLE [ORANGE BOOK], HMS1568F16, HMS1920O21, HMS2051E11, HMS2091G10, HMS2095F16, HMS2235E20, HMS3260P12, HMS3369I03, HMS3393E11, HMS3655I09, HMS3712F16, HMS5079K18, Pharmakon1600-01500200, CLOTRIMAZOLE [EP MONOGRAPH], CLOTRIMAZOLE [USP IMPURITY], Imidazole,.alpha.-diphenylbenzyl)-, KXB07641, MSK21152, CLOTRIMAZOLE [USP MONOGRAPH], Tox21_110111, Tox21_300415, Tox21_500315, CCG-35563, EBC-11148, HY-10882R, NSC756700, s1606, STK700023, AKOS005607024, LOTRISONE COMPONENT CLOTRIMAZOLE, Tox21_110111_1, CS-1926, DB00257, FC20523, LP00315, NC00035, NSC-756700, SB17418, SDCCGSBI-0050303.P005, Clotrimazole for peak identification CRS, IDI1_000665, MRF-0000070, QTL1_000024, NCGC00015251-01, NCGC00015251-03, NCGC00015251-04, NCGC00015251-05, NCGC00015251-06, NCGC00015251-07, NCGC00015251-08, NCGC00015251-09, NCGC00015251-10, NCGC00015251-11, NCGC00015251-12, NCGC00015251-13, NCGC00015251-14, NCGC00015251-27, NCGC00093761-01, NCGC00093761-02, NCGC00093761-03, NCGC00093761-04, NCGC00093761-05, NCGC00093761-06, NCGC00254538-01, NCGC00261000-01, [(2-chlorophenyl)diphenylmethyl]imidazole, 117829-71-7, AS-13816, HY-10882, SY051361, SBI-0050303.P004, Clotrimazole 100 microg/mL in Acetonitrile, DB-046195, 1-[(2-Chlorophenyl)diphenylmethyl]imidazole, AB00051951, C2867, EU-0100315, NS00000282, ST50994242, SW196431-5, T0506, C06922, D00282, 1-(.alpha.-(2-Chlorophenyl)benzhydryl)imidazole, AB00051951-14, AB00051951_15, AB00051951_16, Clotrimazole, VETRANAL(TM), analytical standard, EN300-7409200, F492467, Q413546, 1-[(2-chlorophenyl)-diphenyl-methyl]-1h-imidazole, 1-[(2-Chlorophenyl)di(phenyl)methyl]-1H-imidazole, 1H-Imidazole, 1-[(2-chlorophenyl)-diphenylmethyl], SR-01000075771-1, SR-01000075771-6, SR-01000075771-8, 1-[(2-Chloro-phenyl)-diphenyl-methyl]-1H-imidazole, BRD-K15916496-001-14-7, BRD-K15916496-001-26-1, BRD-K15916496-001-27-9, SR-01000075771-10, 3ACDFDF8-38E3-4368-85D0-BDF8AE1E6591, Clotrimazole, British Pharmacopoeia (BP) Reference Standard, Clotrimazole, European Pharmacopoeia (EP) Reference Standard, Clotrimazole, United States Pharmacopeia (USP) Reference Standard, 1-(o-Chlorotrityl)imidazole, 1-(o-Chloro-alpha,alpha-diphenylbenzyl)imidazole, Clotrimazole for peak identification, European Pharmacopoeia (EP) Reference Standard, Clotrimazole, Pharmaceutical Secondary Standard, Certified Reference Material
Bioactivity: -
Solubility in Different Solvents
| Solvent | Temperature [K] | Crystal form | Solubility [mg/mL] | Reference |
|---|---|---|---|---|
| 1,4-Dioxane | 288.15 | - | 163.2 | [220] |
| 1,4-Dioxane | 293.15 | - | 186.7 | [220] |
| 1,4-Dioxane | 298.15 | - | 211.9 | [220] |
| 1,4-Dioxane | 303.15 | - | 240.8 | [220] |
| 1,4-Dioxane | 308.15 | - | 273.4 | [220] |
| 1,4-Dioxane | 313.15 | - | 311.9 | [220] |
| 1,4-Dioxane | 318.15 | - | 348.4 | [220] |
| 1,4-Dioxane | 323.15 | - | 391.7 | [220] |
| 1-Butanol | 283.16 | - | 58.36 | [221] |
| 1-Butanol | 288.11 | - | 72.39 | [221] |
| 1-Butanol | 293.15 | - | 90.48 | [221] |
| 1-Butanol | 298.2 | - | 111.7 | [221] |
| 1-Butanol | 303.14 | - | 137.9 | [221] |
| 1-Butanol | 308.18 | - | 170.3 | [221] |
| 1-Butanol | 313.15 | - | 210.2 | [221] |
| 1-Butanol | 318.17 | - | 259.5 | [221] |
| 1-Butanol | 323.16 | - | 317.5 | [221] |
| 1-Hexanol | 283.08 | - | 41.1 | [221] |
| 1-Hexanol | 288.13 | - | 52.31 | [221] |
| 1-Hexanol | 293.16 | - | 65.34 | [221] |
| 1-Hexanol | 298.15 | - | 81.31 | [221] |
| 1-Hexanol | 303.19 | - | 101.0 | [221] |
| 1-Hexanol | 308.14 | - | 123.0 | [221] |
| 1-Hexanol | 313.1 | - | 152.0 | [221] |
| 1-Hexanol | 318.21 | - | 184.6 | [221] |
| 1-Hexanol | 323.17 | - | 224.1 | [221] |
| 1-Octanol | 283.06 | - | 26.26 | [221] |
| 1-Octanol | 288.15 | - | 35.55 | [221] |
| 1-Octanol | 293.13 | - | 45.28 | [221] |
| 1-Octanol | 293.15 | - | 45.5 | [222] |
| 1-Octanol | 298.15 | - | 55.56 | [222] |
| 1-Octanol | 298.19 | - | 55.14 | [221] |
| 1-Octanol | 303.11 | - | 67.18 | [221] |
| 1-Octanol | 303.15 | - | 67.92 | [222] |
| 1-Octanol | 308.15 | - | 83.32 | [222] |
| 1-Octanol | 308.22 | - | 81.82 | [221] |
| 1-Octanol | 313.15 | - | 101.0 | [222] |
| 1-Octanol | 313.18 | - | 101.9 | [221] |
| 1-Octanol | 318.09 | - | 125.1 | [221] |
| 1-Octanol | 323.17 | - | 150.6 | [221] |
| 1-Pentanol | 283.19 | - | 55.2 | [221] |
| 1-Pentanol | 288.15 | - | 69.8 | [221] |
| 1-Pentanol | 293.13 | - | 87.95 | [221] |
| 1-Pentanol | 298.1 | - | 106.7 | [221] |
| 1-Pentanol | 303.12 | - | 131.5 | [221] |
| 1-Pentanol | 308.15 | - | 160.4 | [221] |
| 1-Pentanol | 313.07 | - | 195.0 | [221] |
| 1-Pentanol | 318.14 | - | 237.0 | [221] |
| 1-Pentanol | 323.17 | - | 287.9 | [221] |
| 1-Propanol | 278.15 | - | 59.17 | [220] |
| 1-Propanol | 283.15 | - | 71.61 | [220] |
| 1-Propanol | 283.15 | - | 67.92 | [221] |
| 1-Propanol | 288.12 | - | 81.31 | [221] |
| 1-Propanol | 288.15 | - | 85.5 | [220] |
| 1-Propanol | 293.14 | - | 100.1 | [221] |
| 1-Propanol | 293.15 | - | 101.5 | [220] |
| 1-Propanol | 298.15 | - | 120.8 | [220] |
| 1-Propanol | 298.18 | - | 124.2 | [221] |
| 1-Propanol | 303.15 | - | 141.9 | [220] |
| 1-Propanol | 303.16 | - | 154.2 | [221] |
| 1-Propanol | 308.15 | - | 166.1 | [220] |
| 1-Propanol | 308.15 | - | 191.7 | [221] |
| 1-Propanol | 313.11 | - | 237.8 | [221] |
| 1-Propanol | 313.15 | - | 194.5 | [220] |
| 1-Propanol | 318.15 | - | 225.3 | [220] |
| 1-Propanol | 318.17 | - | 296.2 | [221] |
| 1-Propanol | 323.15 | - | 262.3 | [220] |
| 1-Propanol | 323.18 | - | 368.2 | [221] |
| 2-Butanol | 283.15 | - | 38.81 | [221] |
| 2-Butanol | 288.16 | - | 49.57 | [221] |
| 2-Butanol | 293.21 | - | 62.98 | [221] |
| 2-Butanol | 298.18 | - | 79.96 | [221] |
| 2-Butanol | 303.13 | - | 101.8 | [221] |
| 2-Butanol | 308.15 | - | 129.3 | [221] |
| 2-Butanol | 313.19 | - | 163.1 | [221] |
| 2-Butanol | 318.11 | - | 205.1 | [221] |
| 2-Butanol | 323.14 | - | 255.3 | [221] |
| Acetonitrile | 278.15 | - | 11.63 | [220] |
| Acetonitrile | 283.15 | - | 14.18 | [220] |
| Acetonitrile | 288.15 | - | 17.5 | [220] |
| Acetonitrile | 293.15 | - | 20.86 | [220] |
| Acetonitrile | 298.15 | - | 24.73 | [220] |
| Acetonitrile | 303.15 | - | 29.5 | [220] |
| Acetonitrile | 308.15 | - | 34.89 | [220] |
| Acetonitrile | 313.15 | - | 40.89 | [220] |
| Acetonitrile | 318.15 | - | 47.34 | [220] |
| Acetonitrile | 323.15 | - | 56.24 | [220] |
| Butyl acetate | 283.16 | - | 19.77 | [221] |
| Butyl acetate | 288.19 | - | 23.49 | [221] |
| Butyl acetate | 293.14 | - | 27.47 | [221] |
| Butyl acetate | 298.16 | - | 32.53 | [221] |
| Butyl acetate | 303.11 | - | 38.79 | [221] |
| Butyl acetate | 308.09 | - | 46.01 | [221] |
| Butyl acetate | 313.25 | - | 55.11 | [221] |
| Butyl acetate | 318.15 | - | 65.55 | [221] |
| Butyl acetate | 323.13 | - | 77.9 | [221] |
| Ethanol | 293.2 | - | 92.42 | [219] |
| Ethanol | 298.2 | - | 99.8 | [219] |
| Ethanol | 303.2 | - | 129.0 | [219] |
| Ethanol | 308.2 | - | 149.0 | [219] |
| Ethanol | 313.2 | - | 186.1 | [219] |
| Ethyl acetate | 283.11 | - | 25.69 | [221] |
| Ethyl acetate | 288.17 | - | 29.98 | [221] |
| Ethyl acetate | 293.24 | - | 35.66 | [221] |
| Ethyl acetate | 298.15 | - | 42.08 | [221] |
| Ethyl acetate | 303.14 | - | 50.07 | [221] |
| Ethyl acetate | 308.18 | - | 58.91 | [221] |
| Ethyl acetate | 313.12 | - | 69.24 | [221] |
| Ethyl acetate | 318.16 | - | 81.15 | [221] |
| Ethyl acetate | 323.19 | - | 95.52 | [221] |
| Heptanol | 283.17 | - | 26.99 | [221] |
| Heptanol | 288.14 | - | 37.49 | [221] |
| Heptanol | 293.18 | - | 49.43 | [221] |
| Heptanol | 298.16 | - | 62.69 | [221] |
| Heptanol | 303.1 | - | 78.89 | [221] |
| Heptanol | 308.15 | - | 97.7 | [221] |
| Heptanol | 313.19 | - | 119.3 | [221] |
| Heptanol | 318.08 | - | 146.4 | [221] |
| Heptanol | 323.16 | - | 177.5 | [221] |
| Hexane | 293.15 | - | 0.5858 | [222] |
| Hexane | 298.15 | - | 0.6997 | [222] |
| Hexane | 303.15 | - | 0.8302 | [222] |
| Hexane | 308.15 | - | 0.9898 | [222] |
| Hexane | 313.15 | - | 1.168 | [222] |
| Isoamyl Alcohol | 283.13 | - | 50.92 | [221] |
| Isoamyl Alcohol | 288.18 | - | 62.5 | [221] |
| Isoamyl Alcohol | 293.14 | - | 77.6 | [221] |
| Isoamyl Alcohol | 298.16 | - | 96.01 | [221] |
| Isoamyl Alcohol | 303.13 | - | 119.2 | [221] |
| Isoamyl Alcohol | 308.18 | - | 147.0 | [221] |
| Isoamyl Alcohol | 313.12 | - | 179.8 | [221] |
| Isoamyl Alcohol | 318.15 | - | 221.2 | [221] |
| Isoamyl Alcohol | 323.19 | - | 270.7 | [221] |
| Isobutanol | 283.09 | - | 60.05 | [221] |
| Isobutanol | 288.15 | - | 77.24 | [221] |
| Isobutanol | 293.11 | - | 95.89 | [221] |
| Isobutanol | 298.17 | - | 119.0 | [221] |
| Isobutanol | 303.16 | - | 148.0 | [221] |
| Isobutanol | 308.21 | - | 184.2 | [221] |
| Isobutanol | 313.15 | - | 229.0 | [221] |
| Isobutanol | 318.14 | - | 283.1 | [221] |
| Isobutanol | 323.18 | - | 346.3 | [221] |
| Isopropanol | 278.15 | - | 36.1 | [220] |
| Isopropanol | 283.1 | - | 26.17 | [221] |
| Isopropanol | 283.15 | - | 43.57 | [220] |
| Isopropanol | 288.15 | - | 52.36 | [220] |
| Isopropanol | 288.15 | - | 33.01 | [221] |
| Isopropanol | 293.13 | - | 41.67 | [221] |
| Isopropanol | 293.15 | - | 62.56 | [220] |
| Isopropanol | 298.15 | - | 74.86 | [220] |
| Isopropanol | 298.16 | - | 52.1 | [221] |
| Isopropanol | 303.12 | - | 65.77 | [221] |
| Isopropanol | 303.15 | - | 88.52 | [220] |
| Isopropanol | 308.15 | - | 103.6 | [220] |
| Isopropanol | 308.15 | - | 83.48 | [221] |
| Isopropanol | 313.15 | - | 120.2 | [220] |
| Isopropanol | 313.19 | - | 106.2 | [221] |
| Isopropanol | 318.15 | - | 140.1 | [220] |
| Isopropanol | 318.16 | - | 135.6 | [221] |
| Isopropanol | 323.15 | - | 162.7 | [220] |
| Isopropanol | 323.15 | - | 173.8 | [221] |
| Methyl acetate | 283.15 | - | 29.33 | [221] |
| Methyl acetate | 288.17 | - | 34.94 | [221] |
| Methyl acetate | 293.1 | - | 41.82 | [221] |
| Methyl acetate | 298.21 | - | 49.9 | [221] |
| Methyl acetate | 303.15 | - | 59.51 | [221] |
| Methyl acetate | 308.16 | - | 70.95 | [221] |
| Methyl acetate | 313.12 | - | 84.55 | [221] |
| Methyl acetate | 318.14 | - | 100.9 | [221] |
| Methyl acetate | 323.18 | - | 120.6 | [221] |
| Propyl acetate | 283.15 | - | 24.0 | [221] |
| Propyl acetate | 288.14 | - | 28.9 | [221] |
| Propyl acetate | 293.19 | - | 34.06 | [221] |
| Propyl acetate | 298.17 | - | 39.83 | [221] |
| Propyl acetate | 303.16 | - | 46.95 | [221] |
| Propyl acetate | 308.12 | - | 55.42 | [221] |
| Propyl acetate | 313.21 | - | 64.8 | [221] |
| Propyl acetate | 318.15 | - | 76.51 | [221] |
| Propyl acetate | 323.13 | - | 90.15 | [221] |
| Water | 278.15 | - | 2.0 × 10⁻⁴ | [220] |
| Water | 283.15 | - | 2.0 × 10⁻⁴ | [220] |
| Water | 288.15 | - | 3.0 × 10⁻⁴ | [220] |
| Water | 293.15 | - | 4.0 × 10⁻⁴ | [220] |
| Water | 293.2 | - | 5.0 × 10⁻⁴ | [219] |
| Water | 298.15 | - | 5.0 × 10⁻⁴ | [220] |
| Water | 298.2 | - | 6.0 × 10⁻⁴ | [219] |
| Water | 303.15 | - | 6.0 × 10⁻⁴ | [220] |
| Water | 303.2 | - | 6.0 × 10⁻⁴ | [219] |
| Water | 308.15 | - | 7.0 × 10⁻⁴ | [220] |
| Water | 308.2 | - | 7.0 × 10⁻⁴ | [219] |
| Water | 313.15 | - | 9.0 × 10⁻⁴ | [220] |
| Water | 313.2 | - | 8.0 × 10⁻⁴ | [219] |
| Water | 318.15 | - | 0.0011 | [220] |
| Water | 323.15 | - | 0.0013 | [220] |
| isopropyl acetate | 283.1 | - | 15.58 | [221] |
| isopropyl acetate | 288.16 | - | 18.38 | [221] |
| isopropyl acetate | 293.2 | - | 21.7 | [221] |
| isopropyl acetate | 298.19 | - | 25.62 | [221] |
| isopropyl acetate | 303.15 | - | 29.93 | [221] |
| isopropyl acetate | 308.12 | - | 35.4 | [221] |
| isopropyl acetate | 313.15 | - | 41.68 | [221] |
| isopropyl acetate | 318.19 | - | 49.47 | [221] |
| isopropyl acetate | 323.17 | - | 58.45 | [221] |
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 2070.1600 |
| PMI2 | 2419.2311 |
| PMI3 | 2704.0942 |
| NPR1 | 0.7656 |
| NPR2 | 0.8947 |
| RadiusOfGyration | 3.2296 |
| InertialShapeFactor | 0.0004 |
| Eccentricity | 0.6434 |
| Asphericity | 0.0234 |
| SpherocityIndex | 0.7747 |
| PBF | 1.4768 |