AG000KX6

86386-73-4 | 1H-1,2,4-Triazole-1-ethanol, α-(2,4-difluorophenyl)-α-(1H-1,2,4-triazol-1-ylmethyl)-

AG000KX6

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CAS Number	86386-73-4
Catalog Number	AG000KX6(AGN-PC-04XESC)
Chemical Name	1H-1,2,4-Triazole-1-ethanol, α-(2,4-difluorophenyl)-α-(1H-1,2,4-triazol-1-ylmethyl)-
IUPAC Name	2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol
InChI	InChI=1S/C13H12F2N6O/c14-10-1-2-11(12(15)3-10)13(22,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9,22H,4-5H2
InChI Key	RFHAOTPXVQNOHP-UHFFFAOYSA-N
MDL Number	MFCD00274549
Molecular Formula	C13H12F2N6O
Molecular Weight	306.2708
NSC Number	758661
SMILES	C(Cn1cncn1)(Cn1cncn1)(O)c1c(F)cc(cc1)F
UNII	8VZV102JFY
Synonyms	Apo Fluconazole, Apo-Fluconazole, Béagyne, Diflucan, Fluc Hexal, Flucobeta, FlucoLich, Fluconazol AbZ, Fluconazol AL, Fluconazol Isis, Fluconazol ratiopharm, Fluconazol Stada, Fluconazol von ct, Fluconazol-Isis, Fluconazol-ratiopharm, Fluconazole, Flunazul, Fungata, Lavisa, Loitin, Neofomiral, Oxifungol, Solacap, Triflucan, UK 49858, UK-49858, UK49858, Zonal, fluconazole, 86386-73-4, Diflucan, Triflucan, Elazor, Biozolene, Biocanol, Fungata, Fluconazol, Fluconazolum, Flucazol, Flucostat, Flukezol, Flunizol, Pritenzol, Zonal, UK 49858, Alflucoz, Oxifugol, 2-(2,4-DIFLUOROPHENYL)-1,3-DI(1H-1,2,4-TRIAZOL-1-YL)PROPAN-2-OL, Canzol, Cryptal, Dimycon, Flusol, Forcan, Syscan, Zoltec, Baten, Mutum, Zemyc, 2-(2,4-Difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol, Fluconazol [Spanish], Fluconazolum [Latin], UK-49858, DRG-0005, UNII-8VZV102JFY, CCRIS 7211, C13H12F2N6O, DIFLUCAN IN SODIUM CHLORIDE 0.9%, HSDB 7420, 2,4-Difluoro-alpha,alpha-bis(1H-1,2,4-triazol-1-ylmethyl)benzyl alcohol, CHEMBL106, 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol, 2-(2,4-Difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)-2-propanol, DIFLUCAN IN DEXTROSE 5% IN PLASTIC CONTAINER, 8VZV102JFY, 1H-1,2,4-Triazole-1-ethanol, alpha-(2,4-difluorophenyl)-alpha-(1H-1,2,4-triazol-1-ylmethyl)-, alpha-(2,4-Difluorophenyl)-alpha-(1H-1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole-1-ethanol, CHEBI:46081, RFHAOTPXVQNOHP-UHFFFAOYSA-N, 2-(2,4-Difluorophenyl)-1,3-di-1H-1,2,4-triazol-1-ylpropan-2-ol, Fluconazole, 98%, MFCD00274549, NCGC00095089-01, Flunazol, Fluzone, Loitin, DIFLUCAN IN SODIUM CHLORIDE 0.9% IN PLASTIC CONTAINER, 2,4-difluoro-,1-bis(1H-1,2,4-triazol-1-ylmethyl)benzyl alcohol, DSSTox_CID_627, DSSTox_RID_75701, DSSTox_GSID_20627, 123631-92-5, Diflazon, Fuconal, Triconal, Diflucan (TN), CPD000471882, SMR000471882, CAS-86386-73-4, FLCZ, Fluconazole & hGCSF, SR-01000765440, Fluconazole [USAN:INN:BAN:JAN], Fluconazole in sodium chloride 0.9%, Alfumet, Biozole, 2-(2,4-difluorophenyl)-1,3-di(1,2,4-triazolyl)propan-2-ol, Trican, Fluconazole & MC-510,011, Fluconazole (f), Fluconazole,(S), Fluconazole in dextrose 5% in plastic container, 2,4-Difluoro-alpha,alpha-1-bis(1H-1,2,4-triazol-1-ylmethyl)benzyl alcohol, Fluzon [Antifungal], Fluconazole [USAN], KS-1059, Fluconazole [USAN:USP:INN:BAN:JAN], Fluconazole in sodium chloride 0.9% in plastic container, Fluconazole in combination with MGCD290, Spectrum_001654, AC1L1FRQ, Spectrum2_001607, Spectrum3_001912, Spectrum4_000090, Spectrum5_001277, F0677, MGCD290 and Fluconazole, AC1Q77FV, cid_3365, MG-3290 and Fluconazole, SCHEMBL3151, BSPBio_003504, KBioGR_000360, KBioSS_002134, Fluconazole capsules (JP17), MLS001066394, MLS001165780, MLS001195645, MLS001304713, MLS001306492, MLS006011884, BIDD:GT0799, DivK1c_001030, SPECTRUM1503975, SPBio_001613, 1-p-tolylpyridin-2(1H)-one, ZINC4009, DTXSID3020627, BDBM25817, CTK4B3573, Fluconazole (JP17/USAN/INN), HMS503M21, KBio1_001030, KBio2_002134, KBio2_004702, KBio2_007270, KBio3_003009, NINDS_001030, HMS1922O10, HMS2090I20, HMS2093M21, HMS2230O22, HMS3259H13, HMS3373I19, HMS3654P15, HMS3715F21, Pharmakon1600-01503975, BCP28522, Fluconazole 2.0 mg/ml in Methanol, HY-B0101, KS-000000NR, 1,2,4-triazol-1-yl)propan-2-ol, Tox21_111419, Tox21_202240, Tox21_300581, 2-(2,4-Difluoro-phenyl)-1,3-bis-[1,2,4]triazol-1-yl-propan-2-ol, ABP001077, AC-428, ANW-42860, BBL005614, CCG-39065, CF0055, DL-407, Fluconazole & Human recombinant granulocyte colony stimulating factor, KM2402, NSC758661, s1331, SBB066063, STK619301, AKOS000280854, Tox21_111419_1, CS-1835, DB00196, Fluconazole, >=98% (HPLC), powder, LS-1858, MCULE-8641424658, NC00650, NSC-758661, RP17876, IDI1_001030, NCGC00095089-02, NCGC00095089-04, NCGC00095089-05, NCGC00095089-06, NCGC00095089-07, NCGC00095089-08, NCGC00095089-09, NCGC00095089-10, NCGC00095089-11, NCGC00254412-01, NCGC00259789-01, 2-(2,4-difluorophenyl)-1,3-di(1H-, AN-15844, BC201651, FCZ, SAM002589905, SAM002589957, SC-12182, SC-26357, SC-35622, ZB000554, SBI-0051880.P002, AB0008515, AB1010904, TL8005609, TR-038046, UK-049858, UK-49,858, FT-0626437, ST51039043, SW199616-2, EN300-53634, C07002, D00322, J10407, AB00052399-07, AB00052399-08, AB00052399_09, AB00052399_10, 386F734, A841625, I06-0069, Q-201120, SR-01000765440-2, SR-01000765440-4, SR-01000765440-8, BRD-K05977355-001-02-6, BRD-K05977355-001-09-1, F2173-0496, Z235354561, Fluconazole, European Pharmacopoeia (EP) Reference Standard, 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)-2-propanol, Fluconazole, United States Pharmacopeia (USP) Reference Standard, 2-(2,4-difluorophenyl)-1,3-bis-(1H-1,2,4-triazol-1-yl)propan-2-ol, 2-[2,4-bis(fluoranyl)phenyl]-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol, 86386-73-4,155347-36-7(H2O),159532-41-9(methanesulfonate), Fluconazole, Pharmaceutical Secondary Standard; Certified Reference Material, Fluconazole for peak identification, European Pharmacopoeia (EP) Reference Standard, Fluconazole solution, 2.0 mg/mL in methanol, ampule of 1 mL, certified reference material, .alpha.-(2,4-Difluorophenyl)-.alpha.-(1H-1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole-1-ethanol, 340962-81-4, ALPHA-(2,4-DIFLUOROPHENYL)-ALPHA-(1H-1,2,4-TRIAZOLE-1-YLMETHYL)-1H-1,2,4-TRIAZOLE-1-ETHANOL, FLUCONAZOLE; ALPHA-(2,4-DIFLUOROPHENYL)-ALPHA-(1H-1,2,4-TRIAZOLE-1-YLMETHYL)-1H-1,2,4-TRIAZOLE-1-ETHANOL; ELAZOR; TRIFLUCAN; BIOZOLENE, Afungil, difluconazole, Neofomiral, Flucobeta, Flunazul, Oxifungol, Beagyne, Solacap, Lavisa, FlucoLich, Apo Fluconazole, Apo-Fluconazole, Fluconazol Isis, Fluconazol-Isis, Fluconazol AbZ, Fluconazol AL, Fluconazol Stada, Fluc Hexal, Fluzon, Fluconazol von ct, Fluconazol ratiopharm, Fluconazol-ratiopharm, Alfumet (TN), Trican (TN), Flucytosine & Nyotran, AbZ Brand of Fluconazole, SAT Brand of Fluconazole, Mack Brand of Fluconazole, Vita Brand of Fluconazole, Aliud Brand of Fluconazole, D09LNI, Effik Brand of Fluconazole, Hexal Brand of Fluconazole, Lesvi Brand of Fluconazole, Stada Brand of Fluconazole, XMP.284 & Fluconazole, XMP.366 & Fluconazole, XMP.391 & Fluconazole, Apotex Brand of Fluconazole, Chemia Brand of Fluconazole, Pfizer Brand of Fluconazole, Pfleger Brand of Fluconazole, Silanes Brand of Fluconazole, Alpharma Brand of Fluconazole, GL663142 & Fluconazole, betapharm Brand of Fluconazole, Armstrong Brand of Fluconazole, Nepicastat (SYN-117) HCl, Fluconazole (JAN/USAN/INN), ratiopharm Brand of Fluconazole, Fluconazole & Bovine Lactoferrin, CID3365, Lichtenstein Brand of Fluconazole, Fluconazole, 98.5% - 1g 1g, Fluconazole [USAN:BAN:INN:JAN], UK49858, ct Arzneimittel Brand of Fluconazole, ct-Arzneimittel Brand of Fluconazole, C13-H12-F2-N6-O, ACN-048740, CS-O-00201, Diflucan, Trican, Alfumet, Fluconazole, Flucytosine & Nyotran(Liposomal Nystatin), 3-(CYCLOPROPYLMETHYL)PIPERIDIN-2-ONE, B2094, D015725, DIFLUCAN IN SODIUM CHLORIDE 0.9%IN PLASTIC CONTAINER, FLC, TPF, 1-(24-Difluorophenyl)-11-bis[(1H-124-triazol-1-yl)methyl]methanol, 1-(2,4-Difluorofenil) [-1,1-bis (1H-1,2,4-triazol-1-il) metanol metil], 1H-1,2,4-triazol-1-etanol, alfa (2,4-difluorofenil)-alfa (1H-1,2,4-triazol-1-ilmetil)-, 2,4-DIFLUORO-ALPHA,ALPHA-1-BIS(1H-1,2,4-TRIAZOL-1-YLMETHYL)BENZYLALCOHOL, (S)-5-(aminomethyl)-1-(5,7-difluoro-1,2,3,4-tetrahydronaphthalen-2-yl)-1H-imidazole-2(3H)-thione hydrochloride, 170151-24-3, 19006-80-5, alpha-(2,4-Difluorophenyl)alpha-(1H-1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole-1-ethanol, FLU, FLZ,

Complexity	358
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	306.104g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	306.277g/mol
Monoisotopic Mass	306.104g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	81.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H225-H301+H311+H331-H370-H302-H315-H319-H335
Packing Group
Precautionary statements	P280a-P304+P340-P405-P501a-P210-P260-P280-P301+P310-P311-P301+P312+P330-P305+P351+P338-P261
UN Code	\N

Certificate of Analysis

Lot Number