Sulfanilamide

CAS Number: 63-74-1

Molecular Mass: 172.21 g/mol

Formula: C₆H₈N₂O₂S

Smiles: Nc1ccc(S(N)(=O)=O)cc1

Synonymes:

Sulfanilamide, sulfanilamide, 4-Aminobenzenesulfonamide, 63-74-1, Sulphanilamide, Sulfamine, p-Aminobenzenesulfonamide, Sulfonamide, Sulphonamide, Prontylin, Sulfonylamide, Bacteramid, Prontosil Album, Prontosil I, Estreptocida, 4-Aminobenzene-1-Sulfonamide, p-Aminobenzenesulfamide, Streptasol, Streptocid, p-Sulfamoylaniline, 4-Sulfamoylaniline, Sulfonamide P, Benzenesulfonamide, 4-amino-, Antistrept, Astreptine, Collomide, Colsulanyde, Copticide, Ergaseptine, Exoseptoplix, Gombardol, Neococcyl, Orgaseptine, Prontalbin, Proseptal, Septoplex, Septoplix, Streptoclase, Sulfamidyl, Sulfanalone, Sulfanidyl, Sulfocidine, Albexan, Albosal, Ambeside, Astrocid, Deseptyl, Erysipan, Gerison, p-Sulfamidoaniline, Sanamid, Sulfana, Sulfanil, Lusil, Sulfanilimidic acid, Streptocid album, p-Anilinesulfonamide, p-Aminophenylsulfonamide, Streptrocide, Bactesid, Lysococcine, PABS, Proseptine, Proseptol, Pysococcine, Septanilam, Septinal, Septolix, Strepamide, Strepsan, Streptagol, Streptamid, Streptamin, Streptocom, Strepton, Streptopan, Streptosil, Streptozol, Streptozone, Sulfocidin, Therapol, Dipron, Infepan, Stramid, Tolder, Prontosil White, Septamide Album, Pronzin Album, Stopton Album, Rubiazol A, White streptocide, 4-Aminophenylsulfonamide, Streptocide White, Streptocide, Aniline-p-sulfonic amide, Fourneau 1162, Streptocidum, Sulfanilamida, Sulfanilamidum, Benzenesulfonamide, p-amino-, Solfanilamide, Sulphanilamidum, 4-(Aminosulfonyl)aniline, 4-azanylbenzenesulfonamide, 1162 F, A-349, F 1162, para-aminobenzenesulfonamide, NSC-7618, F-1162, DTXSID4023622, CHEBI:45373, NSC7618, 4-aminobenzene sulfonic acid amide, 21240MF57M, DTXCID903622, 4 aminobenzenesulfonamide, RefChem:6271, 4-aminobenzenesulfonimidic acid, CHEBI:35358, D06BA05, J01EB06, 200-563-4, p-Aminobenzenesulfonylamide, Sulfanilamide Vaginal Cream, MFCD00007939, p-Aminobenzensulfonamide, 4-Amino-benzenesulfonamide, EINECS 200-563-4, CHEMBL21, AVC, (4-(Aminosulfonyl)phenyl)amine, F1162, Sulfanilamide Melting Point Standard, Sulfanilamide (INN), CAS-63-74-1, NCGC00016285-02, NCGC00016285-05, Sulfanilamide, >=99%, SULFANILAMIDE [INN], Streptocide (VAN), Solfanilamide [DCIT], Caswell No. 809A, HSDB 223, Sulfanilamidum [INN-Latin], Sulfanilamida [INN-Spanish], SMR000059035, CCRIS 764, 4-Aminobenzenesulphonamide (Sulphanilamide), SR-01000763435, NSC 7618, EPA Pesticide Chemical Code 077902, BRN 0511852, Sulfanilamide [INN:DCF:NF], AI3-00952, sulphanilic amide, 4-sulphanilamide, Sulfanilamide RS, UNII-21240MF57M, Sulfanilamide CRS, Streptocid (TN), delta-Sulfanilamide, Prestwick_36, 4-sulfamoyl-aniline, 4-sulphamoyl aniline, Spectrum_000489, 4-aminobenzensulfonamide, aniline, 4-sulphamoyl-, Sulfanilamide M.P. RS, Sulfanilamide (Standard), WLN: ZSWR DZ, 4-aminobenzenesulphonamide, p-aminobenzene sulfonamide, Prestwick0_000729, Prestwick1_000729, Prestwick2_000729, Prestwick3_000729, Spectrum2_000846, Spectrum3_001406, Spectrum4_000398, Spectrum5_001081, 4-aminobenzene sulfonamide, 4-aminobenzene-sulfonamide, p-aminosulfonyl phenylamine, SCHEMBL740, SULFANILAMIDE [MI], 4-amino-benzenesulphonamide, Epitope ID:122232, p-amino benzene sulfonamide, AVC (TN), SULFANILAMIDE [HSDB], Oprea1_273157, BSPBio_000658, BSPBio_003052, KBioGR_000955, KBioSS_000969, SULFANILAMIDE [VANDF], 4-14-00-02658 (Beilstein Handbook Reference), MLS001074682, MLS002152940, BIDD:GT0170, DivK1c_000528, SPECTRUM1500646, SULFANILAMIDE [MART.], SULPHANILAMIDUM [HPUS], SPBio_000831, SPBio_002597, Sulfadimethoxine EP Impurity E, SULFANILAMIDE [USP-RS], SULFANILAMIDE [WHO-DD], aromatic sulfonamide compound 5, BPBio1_000724, halogenosulfanilamide deriv. 5a, orb1310915, orb3140139, SCHEMBL1408800, SCHEMBL1807855, SCHEMBL11521963, SCHEMBL11880061, BDBM10857, GTPL12631, HMS501K10, HY-B0242R, KBio1_000528, KBio2_000969, KBio2_003537, KBio2_006105, KBio3_002272, Sulfanilamide, p.a., 99.0%, MSK4015, NINDS_000528, HMS1570A20, HMS1921O07, HMS2092E20, HMS2097A20, HMS2233B19, HMS3370J16, HMS3655K19, HMS3714A20, HMS3744M13, HMS5079F12, Pharmakon1600-01500646, Ro13354, SULFANILAMIDE [ORANGE BOOK], HY-B0242, SULFANILAMIDE [EP MONOGRAPH], Tox21_110351, Tox21_201331, Tox21_303336, 4-AMINO-1-BENZENESULFONAMIDE, AC9456, aromatic/heteroaromatic sulfonamide 2, BBL005257, c1264, CCG-40302, EBC-04045, MSK4015-100M, NSC757404, s1685, SBB008928, STK298902, AKOS000119305, MSK4015-1000M, Tox21_110351_1, DB00259, FS07881, NSC-757404, IDI1_000528, NCGC00016285-01, NCGC00016285-03, NCGC00016285-04, NCGC00016285-06, NCGC00016285-08, NCGC00091144-01, NCGC00091144-02, NCGC00091144-03, NCGC00257174-01, NCGC00258883-01, AS-13239, BP-12552, DA-58177, ST079295, Sulfanilamide (4-Aminobenzenesulfonamide), SY009959, SBI-0051575.P002, AB00052138, NS00000007, S0381, S0833, SULFADIAZINE IMPURITY D [EP IMPURITY], SW196353-3, T0123, EN300-16979, SULFADIMIDINE IMPURITY D [EP IMPURITY], Sulfanilamide 1000 microg/mL in Acetonitrile, Sulfanilamide Solution in Methanol, 100ug/mL, Sulfanilamide, JIS special grade, >=99.7%, Sulfanilamide, Vetec(TM) reagent grade, 97%, C07458, D08543, Sulfanilamide Solution in Methanol, 1000ug/mL, AB00052138-10, AB00052138_11, AB00052138_12, SULFADIMETHOXINE IMPURITY E [EP IMPURITY], SULFAMETHOXAZOLE IMPURITY E [EP IMPURITY], AC-907/25014139, F037364, Q423423, Sulfanilamide, VETRANAL(TM), analytical standard, SR-01000763435-2, SR-01000763435-3, SR-01000763435-4, BRD-K02594908-001-15-6, BRD-K02594908-001-16-4, SULFACETAMIDE SODIUM IMPURITY A [EP IMPURITY], Z56851240, F2190-0451, BENZENESULFONIC ACID,4-AMINO,AMIDE SULFANILAMIDE, Sulfanilamide, European Pharmacopoeia (EP) Reference Standard, Sulfanilamide, United States Pharmacopeia (USP) Reference Standard, Reagecon Melting Point Sulphanilamide +164 to +166 degrees C Standard, SULFADIMETHOXINE SODIUM FOR VETERINARY USE IMPURITY E [EP IMPURITY], InChI=1/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10, Reagecon Sulphanilamide Test Solution according to Chinese Pharmacopoeia (ChP), Sulfanilamide Melting Point Standard, United States Pharmacopeia (USP) Reference Standard, Sulfanilamide melting point standard, Pharmaceutical Secondary Standard, Certified Reference Material, Sulfanilamide, Sulfamethoxazole EP Impurity E, Sulfadiazine EP Impurity D, Sulfadimidine EP Impurity D, Sulfadimethoxine EP Impurity E

Bioactivity: -

Solubility in Different Solvents

Solvent	Temperature [K]	Crystal form	Solubility [mg/mL]	Reference
1,4-Dioxane	293.15	-	173.1	[238]
1,4-Dioxane	293.15	-	173.1	[252]
1,4-Dioxane	303.15	-	223.7	[238]
1,4-Dioxane	303.15	-	223.7	[252]
1,4-Dioxane	308.15	-	232.0	[238]
1,4-Dioxane	308.15	-	232.0	[252]
1,4-Dioxane	313.15	-	257.6	[238]
1,4-Dioxane	313.15	-	257.5	[252]
1,4-Dioxane	323.15	-	324.9	[238]
1,4-Dioxane	323.15	-	324.9	[252]
1-Butanol	278.15	-	2.301	[253]
1-Butanol	283.15	-	2.55	[253]
1-Butanol	283.15	-	1.464	[254]
1-Butanol	288.15	-	2.807	[253]
1-Butanol	288.75	-	1.921	[254]
1-Butanol	293.15	-	3.162	[253]
1-Butanol	293.25	-	2.401	[254]
1-Butanol	298.15	-	3.673	[253]
1-Butanol	298.25	-	3.116	[254]
1-Butanol	303.15	-	4.236	[253]
1-Butanol	303.15	-	3.785	[254]
1-Butanol	308.15	-	4.803	[253]
1-Butanol	308.15	-	4.747	[254]
1-Butanol	313.15	-	5.633	[253]
1-Butanol	313.15	-	5.728	[254]
1-Butanol	318.15	-	6.579	[253]
1-Butanol	318.15	-	6.971	[254]
1-Butanol	323.15	-	8.267	[254]
1-Octanol	278.15	-	0.3473	[253]
1-Octanol	283.15	-	0.3874	[253]
1-Octanol	288.15	-	0.4375	[253]
1-Octanol	293.15	-	0.4957	[253]
1-Octanol	298.15	-	0.5676	[253]
1-Octanol	298.15	-	0.5523	[50]
1-Octanol	303.15	-	0.655	[253]
1-Octanol	303.15	-	0.6503	[50]
1-Octanol	308.15	-	0.7598	[253]
1-Octanol	308.15	-	0.808	[50]
1-Octanol	313.15	-	0.889	[253]
1-Octanol	313.15	-	0.9471	[50]
1-Octanol	318.15	-	1.04	[253]
1-Pentanol	293.15	-	1.01	[238]
1-Pentanol	303.15	-	1.255	[238]
1-Pentanol	308.15	-	1.501	[238]
1-Pentanol	313.15	-	1.961	[238]
1-Pentanol	323.15	-	2.898	[238]
1-Propanol	278.15	-	2.298	[253]
1-Propanol	283.15	-	3.012	[253]
1-Propanol	283.35	-	3.527	[254]
1-Propanol	288.15	-	4.056	[253]
1-Propanol	288.55	-	4.574	[254]
1-Propanol	293.15	-	5.306	[253]
1-Propanol	293.15	-	5.276	[254]
1-Propanol	298.15	-	6.878	[253]
1-Propanol	298.35	-	6.237	[254]
1-Propanol	303.15	-	8.344	[253]
1-Propanol	303.15	-	7.609	[254]
1-Propanol	308.15	-	10.11	[253]
1-Propanol	308.15	-	8.794	[254]
1-Propanol	313.15	-	12.17	[253]
1-Propanol	313.15	-	10.25	[254]
1-Propanol	318.15	-	13.88	[253]
1-Propanol	318.15	-	12.31	[254]
1-Propanol	323.15	-	13.98	[254]
2-Butanol	278.15	-	0.183	[253]
2-Butanol	283.15	-	0.4774	[253]
2-Butanol	283.25	-	0.6713	[254]
2-Butanol	288.15	-	0.7102	[253]
2-Butanol	288.15	-	0.8639	[254]
2-Butanol	293.15	-	1.352	[253]
2-Butanol	293.25	-	1.12	[254]
2-Butanol	298.15	-	1.75	[253]
2-Butanol	298.15	-	1.421	[254]
2-Butanol	303.15	-	2.445	[253]
2-Butanol	303.15	-	1.822	[254]
2-Butanol	308.15	-	3.131	[253]
2-Butanol	308.15	-	2.573	[254]
2-Butanol	313.15	-	3.946	[253]
2-Butanol	313.15	-	3.211	[254]
2-Butanol	318.15	-	5.056	[253]
2-Butanol	318.15	-	4.29	[254]
2-Butanol	323.15	-	5.132	[254]
Acetone	278.15	-	217.1	[253]
Acetone	283.15	-	222.9	[253]
Acetone	283.45	-	234.3	[254]
Acetone	288.15	-	228.9	[253]
Acetone	288.45	-	238.5	[254]
Acetone	293.15	-	235.1	[253]
Acetone	293.35	-	244.6	[254]
Acetone	298.15	-	241.9	[253]
Acetone	298.15	-	249.8	[254]
Acetone	303.15	-	249.7	[253]
Acetone	303.15	-	255.0	[254]
Acetone	308.15	-	257.0	[253]
Acetone	308.15	-	250.1	[254]
Acetone	313.15	-	267.9	[253]
Acetone	313.15	-	263.3	[254]
Acetone	318.15	-	280.1	[253]
Acetone	318.15	-	278.7	[254]
Acetone	323.15	-	293.0	[254]
Acetonitrile	293.15	-	12.09	[238]
Acetonitrile	293.15	-	12.1	[252]
Acetonitrile	303.15	-	16.65	[238]
Acetonitrile	303.15	-	16.64	[252]
Acetonitrile	308.15	-	24.52	[238]
Acetonitrile	308.15	-	24.5	[252]
Acetonitrile	313.15	-	36.34	[238]
Acetonitrile	313.15	-	36.33	[252]
Acetonitrile	323.15	-	53.98	[238]
Acetonitrile	323.15	-	53.99	[252]
Benzene	278.15	-	1.32	[253]
Benzene	283.15	-	1.599	[253]
Benzene	288.15	-	1.91	[253]
Benzene	293.15	-	2.264	[253]
Benzene	298.15	-	2.654	[253]
Benzene	303.15	-	3.085	[253]
Benzene	308.15	-	3.555	[253]
Benzene	313.15	-	4.067	[253]
Benzene	318.15	-	4.629	[253]
Butyl acetate	293.15	-	1.44	[238]
Butyl acetate	303.15	-	1.533	[238]
Butyl acetate	308.15	-	1.612	[238]
Butyl acetate	313.15	-	1.76	[238]
Butyl acetate	323.15	-	1.938	[238]
Chloroform	278.15	-	0.00201	[251]
Chloroform	283.15	-	0.00274	[251]
Chloroform	288.15	-	0.0037	[251]
Chloroform	293.15	-	0.0049	[251]
Chloroform	298.15	-	0.0062	[251]
Chloroform	303.15	-	0.0078	[251]
Chloroform	308.15	-	0.0095	[251]
Chloroform	313.15	-	0.01138	[251]
Chloroform	318.15	-	0.01336	[251]
Dimethyl sulfoxide	293.15	-	31.25	[238]
Dimethyl sulfoxide	293.15	-	31.24	[252]
Dimethyl sulfoxide	303.15	-	42.02	[238]
Dimethyl sulfoxide	303.15	-	42.01	[252]
Dimethyl sulfoxide	308.15	-	50.61	[238]
Dimethyl sulfoxide	308.15	-	50.6	[252]
Dimethyl sulfoxide	313.15	-	59.99	[238]
Dimethyl sulfoxide	313.15	-	59.99	[252]
Dimethyl sulfoxide	323.15	-	80.55	[238]
Dimethyl sulfoxide	323.15	-	80.55	[252]
Dimethylformamide	293.15	-	42.62	[238]
Dimethylformamide	293.15	-	42.61	[252]
Dimethylformamide	303.15	-	57.34	[238]
Dimethylformamide	303.15	-	57.33	[252]
Dimethylformamide	308.15	-	73.14	[238]
Dimethylformamide	308.15	-	73.14	[252]
Dimethylformamide	313.15	-	97.62	[238]
Dimethylformamide	313.15	-	97.61	[252]
Dimethylformamide	323.15	-	142.5	[238]
Dimethylformamide	323.15	-	142.5	[252]
Ethanol	278.15	-	18.38	[251]
Ethanol	278.15	-	16.51	[253]
Ethanol	283.15	-	20.66	[251]
Ethanol	283.15	-	19.68	[253]
Ethanol	288.15	-	24.32	[251]
Ethanol	288.15	-	23.61	[253]
Ethanol	293.15	-	28.89	[251]
Ethanol	293.15	-	21.67	[252]
Ethanol	293.15	-	28.39	[253]
Ethanol	298.15	-	34.6	[251]
Ethanol	298.15	-	34.25	[253]
Ethanol	303.15	-	41.21	[251]
Ethanol	303.15	-	33.78	[252]
Ethanol	303.15	-	41.27	[253]
Ethanol	308.15	-	48.62	[251]
Ethanol	308.15	-	43.48	[252]
Ethanol	308.15	-	49.93	[253]
Ethanol	313.15	-	56.9	[251]
Ethanol	313.15	-	56.03	[252]
Ethanol	313.15	-	60.46	[253]
Ethanol	318.15	-	65.9	[251]
Ethanol	318.15	-	73.34	[253]
Ethanol	323.15	-	78.47	[252]
Ethyl acetate	278.15	-	0.016	[253]
Ethyl acetate	283.15	-	0.018	[253]
Ethyl acetate	288.15	-	0.023	[253]
Ethyl acetate	293.15	-	0.0264	[253]
Ethyl acetate	298.15	-	0.0332	[253]
Ethyl acetate	303.15	-	0.0451	[253]
Ethyl acetate	308.15	-	0.0569	[253]
Ethyl acetate	313.15	-	0.0753	[253]
Ethyl acetate	318.15	-	0.1	[253]
Ethylene Glycol	293.15	-	2.043	[238]
Ethylene Glycol	303.15	-	2.37	[238]
Ethylene Glycol	308.15	-	2.581	[238]
Ethylene Glycol	313.15	-	2.903	[238]
Ethylene Glycol	323.15	-	3.507	[238]
Hexane	293.15	-	0.174	[238]
Hexane	303.15	-	0.1872	[238]
Hexane	308.15	-	0.1949	[238]
Hexane	313.15	-	0.1986	[238]
Hexane	323.15	-	0.207	[238]
Isopropanol	278.15	-	0.4624	[253]
Isopropanol	283.15	-	0.8288	[253]
Isopropanol	283.25	-	1.215	[254]
Isopropanol	288.15	-	1.334	[253]
Isopropanol	288.95	-	1.843	[254]
Isopropanol	293.15	-	2.303	[253]
Isopropanol	293.65	-	2.372	[254]
Isopropanol	298.15	-	3.917	[253]
Isopropanol	298.15	-	3.672	[254]
Isopropanol	303.15	-	5.177	[253]
Isopropanol	303.15	-	4.739	[254]
Isopropanol	308.15	-	7.165	[253]
Isopropanol	308.15	-	6.875	[254]
Isopropanol	313.15	-	9.277	[253]
Isopropanol	313.15	-	8.474	[254]
Isopropanol	318.15	-	12.87	[253]
Isopropanol	318.15	-	10.96	[254]
Isopropanol	323.15	-	14.76	[254]
Methanol	278.15	-	46.61	[251]
Methanol	278.15	-	49.24	[253]
Methanol	283.15	-	60.04	[251]
Methanol	283.15	-	59.48	[253]
Methanol	288.15	-	75.59	[251]
Methanol	288.15	-	71.57	[253]
Methanol	293.15	-	93.13	[251]
Methanol	293.15	-	86.16	[253]
Methanol	298.15	-	112.1	[251]
Methanol	298.15	-	103.3	[253]
Methanol	303.15	-	132.7	[251]
Methanol	303.15	-	123.5	[253]
Methanol	308.15	-	154.9	[251]
Methanol	308.15	-	148.3	[253]
Methanol	313.15	-	178.8	[251]
Methanol	313.15	-	176.4	[253]
Methanol	318.15	-	203.9	[251]
Methanol	318.15	-	210.7	[253]
Toluene	278.15	-	0.00609	[251]
Toluene	278.15	-	0.0066	[253]
Toluene	283.15	-	0.00917	[251]
Toluene	283.15	-	0.0098	[253]
Toluene	288.15	-	0.0132	[251]
Toluene	288.15	-	0.013	[253]
Toluene	293.15	-	0.01928	[251]
Toluene	293.15	-	0.0178	[253]
Toluene	298.15	-	0.02304	[251]
Toluene	298.15	-	0.0226	[253]
Toluene	303.15	-	0.03013	[251]
Toluene	303.15	-	0.0272	[253]
Toluene	308.15	-	0.03571	[251]
Toluene	308.15	-	0.0335	[253]
Toluene	313.15	-	0.04185	[251]
Toluene	313.15	-	0.0396	[253]
Toluene	318.15	-	0.04903	[251]
Toluene	318.15	-	0.047	[253]
Water	278.15	-	3.002	[253]
Water	283.15	-	3.623	[253]
Water	288.15	-	4.73	[253]
Water	293.15	-	6.608	[252]
Water	293.15	-	6.073	[253]
Water	298.15	-	7.755	[253]
Water	298.15	-	7.407	[50]
Water	303.15	-	10.84	[252]
Water	303.15	-	10.06	[253]
Water	303.15	-	9.775	[50]
Water	308.15	-	14.03	[252]
Water	308.15	-	12.75	[253]
Water	308.15	-	13.25	[50]
Water	313.15	-	17.8	[252]
Water	313.15	-	16.31	[253]
Water	313.15	-	16.6	[50]
Water	318.15	-	20.53	[253]
Water	323.15	-	22.86	[252]

Molecule 3D descriptors

Descriptor	Value
PMI1	197.0234
PMI2	898.4624
PMI3	985.6010
NPR1	0.1999
NPR2	0.9116
RadiusOfGyration	2.4581
InertialShapeFactor	0.0046
Eccentricity	0.9798
Asphericity	0.5179
SpherocityIndex	0.1834
PBF	0.4776