5-fluorouracil

CAS Number: 51-21-8

Molecular Mass: 130.08 g/mol

Formula: C₄H₃FN₂O₂

Smiles: O=c1[nH]cc(F)c(=O)[nH]1

Synonymes:

5-fluorouracil, 5-Fluorouracil, fluorouracil, 51-21-8, Efudex, Fluracil, Fluoroblastin, Carzonal, Queroplex, Fluril, Phthoruracil, Arumel, Timazin, Fluracilum, Ulup, 5-Fluoracil, Fluorouracilum, Fluro Uracil, 5 Fluorouracil, 5-Fluoruracil, 5-Fluoro-2,4(1H,3H)-pyrimidinedione, Fluorouracilo, Ftoruracil, Efurix, Effluderm (free base), Fluroblastin, 5-Fluoropyrimidine-2,4-dione, Fluoro-uracile, Fluoro-uracilo, Uracil, 5-fluoro-, 2,4(1H,3H)-Pyrimidinedione, 5-fluoro-, Ro 2-9757, 5-Faracil, Cinco FU, Fluorouracile, NSC-19893, 2,4-Dioxo-5-fluoropyrimidine, Fluorouricil, Tolak, Ro-2-9757, 5-Fluoropyrimidin-2,4-diol, NSC 19893, U-8953, Fluouracil, DTXSID2020634, Fluoro Uracil, 5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione, 5-Fluracil, U3P01618RT, NSC19893, Ro-29757, DTXCID40634, CHEBI:46345, Flurodex, Haemato fu, Fluorouracil GRY, 5 FU Lederle, Fluoro Uracile ICN, Fluoro-Uracile ICN, 5 FU medac, 5 HU Hexal, Dakota, Fluorouracile, 5 Fluorouracil biosyn, Flurablastin, AccuSite, 5 Fluorouracilum, Fluoro-uracil roche, RefChem:56970, L01BC02, 5-Fluoro-2,4(1H, 3H)-pyrimidinedione, 200-085-6, Fluoruracil, 5-FU, Fluoroplex, Adrucil, Carac, 5-fluoropyrimidine-2,4(1H,3H)-dione, Kecimeton, 5-fluoro-1H-pyrimidine-2,4-dione, Efudix, Fluri, 5-fluoropyrimidine-2,4-diol, 2,4-Dihydroxy-5-fluoropyrimidine, 5-Fluor-2,4-pyrimidindiol, 5-fluoro uracil, 5-fluoro-uracil, 5-Ftouracyl, Fluorouracil, 5-, 5-Fluoro-2,4-pyrimidinedione, 191047-65-1, 5-Fluor-2,4-dihydroxypyrimidin, MFCD00006018, FU, CHEMBL185, MLS000069498, 5 FU, 191047-64-0, 191115-88-5, 5FU, Phtoruracil, URF, NCGC00015442-02, Effluderm, SMR000038082, Fluorouracile [DCIT], 5-Fluoracil [German], 5-Fluoracyl, 5-Fluoruracil [German], 1004-03-1, Fluorouracilum [INN-Latin], Fluorouracilo [INN-Spanish], Fluorouracil Cream, CAS-51-21-8, Fluoroplex (TN), 5-Fluor-2,4-pyrimidindiol [Czech], Adrucil (TN), 5-fluoro-1,3-dihydropyrimidine-2,4-dione, CCRIS 2582, Carac (TN), 5-Fluor-2,4-dihydroxypyrimidin [Czech], HSDB 3228, SR-01000075881, 5-Fluor-2,4(1H,3H)-pyrimidindion [Czech], EINECS 200-085-6, 5-Fluor-2,4(1H,3H)-pyrimidindion, 2,4-Pyrimidinediol, 5-fluoro- (9CI), inhibits thymilidate synthetase, UNII-U3P01618RT, 2,4-Dioxo-5-fluoropryimidine, 5-fluorourasil, AI3-25297, Fluorouracil RS, 5-florouracil, 5-fluorouacil, L-Arginine:hcl, 5-FU (TN), Fluorouracil CRS, 1upf, 5F-uracil, U 8953, Fluorouracil, 5-Fluoropyrimidine-2,4(1H,3H)-dione, Flucytosine Imp. A (EP), Flucytosine Impurity A, Adrucil (ICN), 5-Fluoro-, 2794-13-0, Adrucil (Fluorouracil), Fluorouracil [USAN:USP:INN:BAN:JAN], Spectrum_000841, Opera_ID_134, 5-Fluorouracil, 99%, Spectrum2_000076, Spectrum3_000434, Spectrum4_000557, Spectrum5_000718, WLN: T6MVMVJ EF, FLUOROURACIL [MI], Lopac-F-6627, F0151, 5-Fluorouracil (5-FU), FLUOROURACIL [INN], FLUOROURACIL [JAN], 5-Fluorouracil (Standard), UPCMLD-DP130, EC 200-085-6, F 6627, FLUOROURACIL [HSDB], FLUOROURACIL [USAN], SCHEMBL3646, 5-fluorpyrimidin-2,4-diol, FLUOROURACIL [VANDF], Folfox component fluorouracil, Lopac0_000536, BSPBio_002048, FLUOROURACIL [MART.], KBioGR_001253, KBioSS_001321, MLS002415705, DivK1c_000054, FLUOROURACIL [USP-RS], FLUOROURACIL [WHO-DD], FLUOROURACIL [WHO-IP], SCHEMBL592897, SPECTRUM1500305, SPBio_000291, 5-FLUOROURACIL [IARC], 5-fluoro-2,4-dioxo-pyrimidin, 5-fluoro-pyrimidine-2,4-diol, GTPL4789, orb1310103, orb3141274, SCHEMBL2733944, SCHEMBL8012255, SCHEMBL10746579, UPCMLD-DP130:001, Fluorouracil (JP18/USP/INN), HMS500C16, KBio1_000054, KBio2_001321, KBio2_003889, KBio2_006457, KBio3_001268, 5-Fluoro-2,3H)-pyrimidinedione, 5-FLUOROURACIL [WHO-IP], 2,4-Pyrimidinedione, 5-fluoro-, NINDS_000054, FLUOROURACIL [ORANGE BOOK], GLXC-07719, HMS1920O18, HMS2090I04, HMS2091F19, HMS3259O03, HMS3261L13, HMS3654K22, HMS3715H03, HMS3865L03, HMS5079C17, Pharmakon1600-01500305, FLUOROURACIL [EP MONOGRAPH], 5-Fluorouracil, analytical standard, MSK10715, TCA94195, 2,3H)-Pyrimidinedione, 5-fluoro-, 5-Fluorouracil - Bio-X trade mark, Fluorouracil (5-Fluoracil, 5-FU), Fluorouracil (5-Fluoracil, 5-FU), FLUOROURACIL [USP MONOGRAPH], Tox21_110150, Tox21_202335, Tox21_300112, Tox21_500536, BDBM50340677, CCG-39879, DL-399, EBC-00529, EBC-44298, EBC-50070, HY-90006R, NSC757036, NSC816997, s1209, SBB085751, STK297802, STL367375, FLUOROURACILUM [WHO-IP LATIN], AKOS000119162, AKOS003237897, AKOS008044307, Tox21_110150_1, CS-0993, DB00544, FF05372, KS-5129, LP00536, NC00454, NSC-757036, NSC-816997, SDCCGSBI-0050519.P005, FLUCYTOSINE IMPURITY A [WHO-IP], Fluorouracil, Flucytosine EP Impurity A, IDI1_000054, NCGC00015442-01, NCGC00015442-03, NCGC00015442-04, NCGC00015442-05, NCGC00015442-06, NCGC00015442-07, NCGC00015442-08, NCGC00015442-09, NCGC00015442-10, NCGC00015442-11, NCGC00015442-12, NCGC00015442-15, NCGC00015442-16, NCGC00015442-24, NCGC00015442-30, NCGC00091349-01, NCGC00091349-02, NCGC00091349-03, NCGC00091349-04, NCGC00091349-05, NCGC00091349-07, NCGC00091349-08, NCGC00254023-01, NCGC00259884-01, NCGC00261221-01, AC-11201, BF166014, EMTRICITABINE IMPURITY F [WHO-IP], HY-90006, NCI60_001652, SRI-10792-04, SRI-10792-05, SRI-10792-06, SRI-10792_07, SRI-10792_08, 5-Fluoro-1H-pyrimidine-2,4-dione(5FU), 5-Fluorouracil, >=99% (HPLC), powder, SBI-0050519.P004, 2(1H)-Pyrimidinone, 5-fluoro-4-hydroxy-, 4(3H)-Pyrimidinone, 5-fluoro-2-hydroxy-, 5-Fluoro-1H-pyrimidine-2,4-dione(5-FU), DB-051923, DB-065735, DB-268958, DB-272209, DB-297613, pyrimidine-2,4(1H,3H)-dione, 5-fluoro-, 5-Fluoro-1H-pyrimidine-2,4-dione (5-FU), EU-0100536, FLUCYTOSINE IMPURITY A [EP IMPURITY], NS00000337, ST45025877, SW199617-3, 5-Fluoro-1H-pyrimidine-2,4-dione(5-FUra), EN300-33909, Fluorouracil, meets USP testing specifications, 3-Trifluoromethyl-4-(S)-2-butoxybenzoic acid, C07649, D00584, 5-fluoro-6-hydroxy-1,2-dihydropyrimidin-2-one, 5-Fluorouracil, Vetec(TM) reagent grade, >=99%, F003241, Q238512, W-60379, (5-fluorouracil)5-Fluoro-1H-pyrimidine-2,4-dione, 4,4-(1,4-PHENYLENE-DI-2,1-ETHYNEDIYL)B, 5-Fluoro-1H-pyrimidine-2,4-dione(5-fluoro uracil), SR-01000075881-1, SR-01000075881-3, SR-01000075881-5, 5-Fluoro-1H-pyrimidine-2,4-dione (5-Fluorouracil), BRD-K24844714-001-02-1, BRD-K24844714-001-24-5, BRD-K24844714-001-25-2, 5-FLUOROPYRIMIDIN-2,4(1H,3H)-DIONE [WHO-IP], Z275128052, 5-Fluoro-1H-pyrimidine-2,4-dione(5-fluorouracil)(5-FU), 5-Fluorouracil, certified reference material, TraceCERT(R), Fluorouracil, British Pharmacopoeia (BP) Reference Standard, Fluorouracil, European Pharmacopoeia (EP) Reference Standard, Fluorouracil, United States Pharmacopeia (USP) Reference Standard, pyrimidine antimetabolite: inhibits nucleic acid replication, tetratogen, Fluorouracil, Pharmaceutical Secondary Standard, Certified Reference Material, InChI=1/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9, 635702-33-9, 665011-29-0

Bioactivity: -

Solubility in Different Solvents

Solvent	Temperature [K]	Crystal form	Solubility [mg/mL]	Reference
1,4-Dioxane	290.2	-	1.718	[281]
1,4-Dioxane	291.3	-	1.885	[281]
1,4-Dioxane	300.9	-	2.396	[281]
1,4-Dioxane	305.2	-	2.656	[281]
1,4-Dioxane	306.4	-	2.819	[281]
1,4-Dioxane	310.4	-	3.076	[281]
1,4-Dioxane	313.3	-	3.261	[281]
1,4-Dioxane	313.9	-	3.364	[281]
1,4-Dioxane	318.0	-	3.676	[281]
1,4-Dioxane	319.5	-	3.834	[281]
1,4-Dioxane	322.8	-	4.205	[281]
1,4-Dioxane	329.8	-	4.878	[281]
1-Butanol	280.1	-	0.835	[281]
1-Butanol	283.0	-	0.847	[281]
1-Butanol	283.15	-	1.454	[280]
1-Butanol	287.8	-	1.23	[281]
1-Butanol	288.15	-	1.618	[280]
1-Butanol	293.15	-	1.815	[280]
1-Butanol	298.15	-	2.085	[280]
1-Butanol	299.5	-	1.456	[281]
1-Butanol	303.15	-	2.373	[280]
1-Butanol	303.4	-	1.705	[281]
1-Butanol	306.3	-	1.981	[281]
1-Butanol	308.15	-	2.766	[280]
1-Butanol	313.15	-	3.238	[280]
1-Butanol	314.8	-	2.538	[281]
1-Butanol	318.15	-	3.749	[280]
1-Butanol	323.15	-	4.295	[280]
1-Butanol	325.8	-	3.59	[281]
1-Butanol	327.0	-	3.683	[281]
1-Butanol	331.5	-	4.3	[281]
1-Pentanol	283.15	-	0.9602	[280]
1-Pentanol	288.15	-	1.09	[280]
1-Pentanol	293.15	-	1.249	[280]
1-Pentanol	298.15	-	1.442	[280]
1-Pentanol	303.15	-	1.674	[280]
1-Pentanol	308.15	-	1.973	[280]
1-Pentanol	313.15	-	2.355	[280]
1-Pentanol	318.15	-	2.664	[280]
1-Pentanol	323.15	-	3.358	[280]
1-Propanol	280.8	-	1.45	[281]
1-Propanol	282.4	-	1.57	[281]
1-Propanol	283.15	-	3.232	[280]
1-Propanol	288.15	-	3.726	[280]
1-Propanol	291.2	-	1.71	[281]
1-Propanol	293.15	-	4.214	[280]
1-Propanol	294.5	-	1.878	[281]
1-Propanol	298.15	-	4.719	[280]
1-Propanol	298.4	-	2.096	[281]
1-Propanol	302.2	-	2.123	[281]
1-Propanol	303.15	-	5.231	[280]
1-Propanol	308.15	-	5.814	[280]
1-Propanol	308.6	-	2.555	[281]
1-Propanol	313.0	-	2.937	[281]
1-Propanol	313.15	-	6.428	[280]
1-Propanol	315.1	-	3.05	[281]
1-Propanol	318.15	-	7.074	[280]
1-Propanol	318.3	-	3.533	[281]
1-Propanol	322.3	-	3.79	[281]
1-Propanol	323.15	-	7.872	[280]
1-Propanol	324.3	-	4.137	[281]
1-Propanol	326.2	-	4.433	[281]
Acetic acid	283.15	-	0.9493	[280]
Acetic acid	288.15	-	1.134	[280]
Acetic acid	293.15	-	1.347	[280]
Acetic acid	298.15	-	1.634	[280]
Acetic acid	303.15	-	2.006	[280]
Acetic acid	308.15	-	2.461	[280]
Acetic acid	313.15	-	2.994	[280]
Acetic acid	318.15	-	3.779	[280]
Acetic acid	323.15	-	4.848	[280]
Acetone	282.9	-	2.735	[281]
Acetone	290.2	-	3.117	[281]
Acetone	298.4	-	3.503	[281]
Acetone	302.5	-	3.833	[281]
Acetone	305.1	-	3.993	[281]
Acetone	307.4	-	4.241	[281]
Acetone	315.2	-	4.81	[281]
Acetone	316.9	-	5.126	[281]
Acetone	322.4	-	5.169	[281]
Acetonitrile	290.3	-	1.15	[281]
Acetonitrile	294.6	-	1.31	[281]
Acetonitrile	299.1	-	1.53	[281]
Acetonitrile	300.3	-	1.62	[281]
Acetonitrile	306.6	-	1.97	[281]
Acetonitrile	307.6	-	2.02	[281]
Acetonitrile	316.0	-	2.45	[281]
Acetonitrile	320.2	-	2.889	[281]
Acetonitrile	329.0	-	3.371	[281]
Acetonitrile	332.3	-	3.801	[281]
Butyric Acid	283.15	-	0.353	[280]
Butyric Acid	288.15	-	0.4208	[280]
Butyric Acid	293.15	-	0.5149	[280]
Butyric Acid	298.15	-	0.6249	[280]
Butyric Acid	303.15	-	0.7799	[280]
Butyric Acid	308.15	-	0.9696	[280]
Butyric Acid	313.15	-	1.216	[280]
Butyric Acid	318.15	-	1.524	[280]
Butyric Acid	323.15	-	1.958	[280]
Dimethylformamide	283.15	-	5.891	[280]
Dimethylformamide	288.15	-	7.704	[280]
Dimethylformamide	293.15	-	9.434	[280]
Dimethylformamide	298.15	-	11.14	[280]
Dimethylformamide	303.15	-	13.12	[280]
Dimethylformamide	308.15	-	15.49	[280]
Dimethylformamide	313.15	-	18.26	[280]
Dimethylformamide	318.15	-	21.09	[280]
Dimethylformamide	323.15	-	23.8	[280]
Ethanol	281.1	-	2.24	[281]
Ethanol	283.15	-	4.563	[280]
Ethanol	286.9	-	2.787	[281]
Ethanol	288.15	-	5.018	[280]
Ethanol	291.2	-	3.065	[281]
Ethanol	293.15	-	5.498	[279]
Ethanol	293.15	-	5.48	[280]
Ethanol	297.7	-	3.71	[281]
Ethanol	298.15	-	6.16	[279]
Ethanol	298.15	-	5.971	[280]
Ethanol	303.15	-	6.79	[279]
Ethanol	303.15	-	6.657	[280]
Ethanol	306.2	-	4.535	[281]
Ethanol	308.15	-	7.48	[279]
Ethanol	308.15	-	7.291	[280]
Ethanol	309.1	-	4.741	[281]
Ethanol	313.15	-	8.361	[279]
Ethanol	313.15	-	8.077	[280]
Ethanol	314.8	-	5.67	[281]
Ethanol	315.1	-	5.823	[281]
Ethanol	318.15	-	8.945	[279]
Ethanol	318.15	-	8.76	[280]
Ethanol	322.8	-	6.92	[281]
Ethanol	323.15	-	9.85	[279]
Ethanol	323.15	-	9.763	[280]
Ethanol	323.7	-	7.11	[281]
Ethanol	325.6	-	7.895	[281]
Ethanol	329.9	-	8.567	[281]
Ethyl acetate	291.1	-	0.547	[281]
Ethyl acetate	297.0	-	0.635	[281]
Ethyl acetate	300.6	-	0.711	[281]
Ethyl acetate	310.8	-	0.818	[281]
Ethyl acetate	320.3	-	0.986	[281]
Ethyl acetate	330.6	-	1.25	[281]
Formic Acid	283.15	-	1.674	[280]
Formic Acid	288.15	-	1.968	[280]
Formic Acid	293.15	-	2.328	[280]
Formic Acid	298.15	-	2.839	[280]
Formic Acid	303.15	-	3.377	[280]
Formic Acid	308.15	-	4.116	[280]
Formic Acid	313.15	-	4.979	[280]
Formic Acid	318.15	-	6.277	[280]
Formic Acid	323.15	-	8.0	[280]
Isoamyl Alcohol	283.15	-	0.8605	[280]
Isoamyl Alcohol	288.15	-	0.9873	[280]
Isoamyl Alcohol	293.15	-	1.13	[280]
Isoamyl Alcohol	298.15	-	1.331	[280]
Isoamyl Alcohol	303.15	-	1.558	[280]
Isoamyl Alcohol	308.15	-	1.843	[280]
Isoamyl Alcohol	313.15	-	2.211	[280]
Isoamyl Alcohol	318.15	-	2.706	[280]
Isoamyl Alcohol	323.15	-	3.204	[280]
Isobutanol	283.15	-	0.8944	[280]
Isobutanol	288.15	-	1.034	[280]
Isobutanol	293.15	-	1.203	[280]
Isobutanol	298.15	-	1.41	[280]
Isobutanol	303.15	-	1.673	[280]
Isobutanol	308.15	-	1.981	[280]
Isobutanol	313.15	-	2.386	[280]
Isobutanol	318.15	-	2.93	[280]
Isobutanol	323.15	-	3.58	[280]
Isopropanol	282.1	-	1.46	[281]
Isopropanol	283.15	-	0.9444	[280]
Isopropanol	284.6	-	1.53	[281]
Isopropanol	286.8	-	1.748	[281]
Isopropanol	288.15	-	1.107	[280]
Isopropanol	293.15	-	1.297	[280]
Isopropanol	294.9	-	2.022	[281]
Isopropanol	298.15	-	1.537	[280]
Isopropanol	301.3	-	2.481	[281]
Isopropanol	302.4	-	2.748	[281]
Isopropanol	303.15	-	1.801	[280]
Isopropanol	308.0	-	3.15	[281]
Isopropanol	308.15	-	2.212	[280]
Isopropanol	311.6	-	3.622	[281]
Isopropanol	313.15	-	2.685	[280]
Isopropanol	316.2	-	3.936	[281]
Isopropanol	318.0	-	4.277	[281]
Isopropanol	318.15	-	3.232	[280]
Isopropanol	323.0	-	4.963	[281]
Isopropanol	323.15	-	4.073	[280]
Isopropanol	327.5	-	5.679	[281]
Isopropanol	330.0	-	6.237	[281]
Methanol	280.0	-	5.391	[281]
Methanol	283.15	-	10.2	[280]
Methanol	287.7	-	6.997	[281]
Methanol	288.15	-	11.56	[280]
Methanol	293.15	-	13.23	[280]
Methanol	295.8	-	9.278	[281]
Methanol	298.15	-	14.88	[280]
Methanol	303.15	-	16.61	[280]
Methanol	306.8	-	12.02	[281]
Methanol	308.15	-	18.39	[280]
Methanol	313.15	-	20.28	[280]
Methanol	318.15	-	22.37	[280]
Methanol	318.4	-	15.71	[281]
Methanol	323.15	-	24.57	[280]
Methanol	326.0	-	18.03	[281]
Methanol	328.8	-	20.46	[281]
Propionic Acid	283.15	-	0.6599	[280]
Propionic Acid	288.15	-	0.7969	[280]
Propionic Acid	293.15	-	0.9358	[280]
Propionic Acid	298.15	-	1.16	[280]
Propionic Acid	303.15	-	1.41	[280]
Propionic Acid	308.15	-	1.734	[280]
Propionic Acid	313.15	-	2.227	[280]
Propionic Acid	318.15	-	2.816	[280]
Propionic Acid	323.15	-	3.618	[280]
Tetrahydrofuran	279.6	-	4.016	[281]
Tetrahydrofuran	283.15	-	0.3519	[283]
Tetrahydrofuran	287.0	-	4.417	[281]
Tetrahydrofuran	288.15	-	0.461	[283]
Tetrahydrofuran	293.15	-	0.575	[283]
Tetrahydrofuran	293.2	-	4.641	[281]
Tetrahydrofuran	298.15	-	0.7498	[283]
Tetrahydrofuran	303.15	-	0.9778	[283]
Tetrahydrofuran	303.8	-	5.199	[281]
Tetrahydrofuran	308.15	-	1.2	[283]
Tetrahydrofuran	308.7	-	5.499	[281]
Tetrahydrofuran	313.15	-	1.502	[283]
Tetrahydrofuran	314.6	-	5.74	[281]
Tetrahydrofuran	318.15	-	1.87	[283]
Tetrahydrofuran	323.15	-	2.329	[283]
Tetrahydrofuran	325.2	-	6.451	[281]
Tetrahydrofuran	328.6	-	6.978	[281]
Water	280.1	-	6.6	[281]
Water	282.5	-	6.74	[281]
Water	283.15	-	7.963	[280]
Water	288.15	-	9.499	[280]
Water	290.8	-	8.958	[281]
Water	293.15	-	11.19	[279]
Water	293.15	-	11.08	[280]
Water	294.5	-	10.6	[281]
Water	298.15	-	12.69	[279]
Water	298.15	-	12.65	[280]
Water	298.15	-	17.93	[282]
Water	303.15	-	14.05	[279]
Water	303.15	-	14.29	[280]
Water	304.4	-	15.1	[281]
Water	308.15	-	15.39	[279]
Water	308.15	-	16.46	[280]
Water	312.1	-	20.65	[281]
Water	313.15	-	17.31	[279]
Water	313.15	-	18.36	[280]
Water	317.5	-	24.11	[281]
Water	318.15	-	19.93	[279]
Water	318.15	-	21.4	[280]
Water	323.0	-	28.71	[281]
Water	323.15	-	22.33	[279]
Water	323.15	-	24.71	[280]

Molecule 3D descriptors

Descriptor	Value
PMI1	156.8418
PMI2	357.1776
PMI3	514.0194
NPR1	0.3051
NPR2	0.6949
RadiusOfGyration	1.9879
InertialShapeFactor	0.0044
Eccentricity	0.9523
Asphericity	0.3639
SpherocityIndex	0.0000
PBF	0.0000