AG003M7A

97963-62-7 | 5-(Difluoromethoxy)-1H-benzo[d]imidazole-2-thiol

AG003M7A

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CAS Number	97963-62-7
Catalog Number	AG003M7A(AGN-PC-0LM0EN)
Chemical Name	5-(Difluoromethoxy)-1H-benzo[d]imidazole-2-thiol
IUPAC Name	5-(difluoromethoxy)-1,3-dihydrobenzimidazole-2-thione
InChI	InChI=1S/C8H6F2N2OS/c9-7(10)13-4-1-2-5-6(3-4)12-8(14)11-5/h1-3,7H,(H2,11,12,14)
InChI Key	HJMVPNAZPFZXCP-UHFFFAOYSA-N
MDL Number	MFCD00467504
Molecular Formula	C8H6F2N2OS
Molecular Weight	216.2078
SMILES	FC(OC1=CC2=C(NC(N2)=S)C=C1)F
UNII	39P59C89NV
Synonyms	97963-62-7, 5-(Difluoromethoxy)-1H-benzo[d]imidazole-2-thiol, 5-DIFLUOROMETHOXY-2-MERCAPTO-1H-BENZIMIDAZOLE, 5-(Difluoromethoxy)-2-mercapto-1H-benzimidazole, 5-(difluoromethoxy)-1H-benzimidazole-2-thiol, UNII-39P59C89NV, 5-(Difluoromethoxy)-2-benzimidazolethiol, 2-Mercapto-5-difluoromethoxy benzimidazole, 5-(Difluoromethoxy)-2-mercaptobenzimidazole, MFCD00467504, 5-Difluoromethoxy-2-thio-benzimidazole, 5-(difluoromethoxy)-1,3-dihydrobenzimidazole-2-thione, 2H-Benzimidazole-2-thione, 5-(difluoromethoxy)-1,3-dihydro-, 5-difluormethoxy-2-mercaepto-1h-benzimidazole, 39P59C89NV, 5-(difluoromethoxy)-1H-1,3-benzodiazole-2-thiol, 5-difluoromethoxy-2-mercaptobenzimidazole, AK-45339, W-204166, 5-(difluoromethoxy)-1,3-dihydro-2H-benzimidazole-2-thione, Sulfurous acid monosodium salt telomer with 2-methyl-2-[(1-oxo-2-propenyl)amino]-1-propanesulfonic acid and 2-propenoic acid sodium salt, Pantoprazole related compound C, SKA-47, Pantoprazole related compound C [USP], PubChem7125, Pantoprazole Impurity C, Pantoprazole related compound C RS [USP], AC1NN9SR, 2-Mercapto-5-difluoromethoxy-1H-benzimidazole, buttpark 16\03-28, ACMC-209s9c, C8H6F2N2OS, KSC486M2B, SCHEMBL482378, CTK3I6620, CTK7B7464, KS-00000MBE, DTXSID80243352, Pantoprazole sodium sesquihydrate specified impurity C [EP], HJMVPNAZPFZXCP-UHFFFAOYSA-N, ALBB-014405, BB_SC-02781, EBD20766, ZINC3882895, ZX-AN013131, ZX-AP004436, ANW-40894, ANW-72261, BBL009927, CD-269, PC9818, SBB063107, STK711091, AKOS005174324, AKOS028108766, AC-8364, AN-8092, CS-W021039, FCH1326331, HCH0024851, MCULE-9489358703, PS-6955, RP17520, RTC-063596, TRA-0206089, 5-(difluoromethoxy)benzimidazole-2-thiol, AJ-46723, CC-21694, CJ-11112, 5-difluoromethoxy-1H-benzimidazole-2-thiol, AB0008370, AX8005915, TC-063596, TC-161006, TL8006030, 5-difluoromethoxy-1H-benzoimidazole-2-thiol, D3438, FT-0620359, FT-0659956, ST24044236, 5-difluormethoxy-2-mercapto-1-h-benzimidazole, 5-(Difluoromethoxy)-1H-benzoimidazole-2-thiol, M-2002, 1H-benzimidazole-2-thiol, 5-(difluoromethoxy)-, 5-difluormethoxy-2-mercapto-1-1-1-benzimidazole, 6-(difluoromethoxy)-1H-1,3-benzodiazole-2-thiol, 963D627, A845773, AG-996/31082058, C-11637, I01-0363, I14-3999, 5-(Difluoromethoxy)-2-mercapto-1H-benzimidazole, 97%, 5-(Difluoromethoxy)-1,3-dihydro-2H-benzo[d]imidazole-2-thione, 5-(difluoromethoxy)-2,3-dihydro-1H-1,3-benzodiazole-2-thione, 5-[bis(fluoranyl)methoxy]-1,3-dihydrobenzimidazole-2-thione, Pantoprazole Related Compound C, United States Pharmacopeia (USP) Reference Standard, 2-Chloro-3-trifluoromethylpyridine, 5- -2-mercapto-1H-benzimidazole, ZINC03882895, ACN-032216, CID5064774, CS-O-31345, 5-Difluoromethoxy-3-mercapto-1H-benzimidazole, EC 417-780-7, 5-(Difluoro methoxy)-2-mercapto-1H-benzimidazole, 2h-benzimidazol-2-tiona, 5-(difluorometoxi)-1,3-dihidro-, 5-(Difluoromethoxy)-2-mercapto-1H-benzimidazole, 97% 1g, 109384-19-2,

Complexity	239
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.017g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	216.206g/mol
Monoisotopic Mass	216.017g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	65.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number