AG003F3E

7152-24-1 | 2-(Methylthio)-1H-benzo[d]imidazole

AG003F3E

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CAS Number	7152-24-1
Catalog Number	AG003F3E(AGN-PC-0JKH4I)
Chemical Name	2-(Methylthio)-1H-benzo[d]imidazole
EC Number	230-494-5
IUPAC Name	2-methylsulfanyl-1H-benzimidazole
InChI	InChI=1S/C8H8N2S/c1-11-8-9-6-4-2-3-5-7(6)10-8/h2-5H,1H3,(H,9,10)
InChI Key	OCKJFOHZLXIAAT-UHFFFAOYSA-N
MDL Number	MFCD00005594
Molecular Formula	C8H8N2S
Molecular Weight	164.2275
NSC Number	21699
SMILES	CSC1=NC2=CC=CC=C2N1
UNII	3O1W4OYE3V
Synonyms	2-(Methylthio)benzimidazole, 7152-24-1, 2-Methylmercaptobenzimidazole, 2-(methylthio)-1H-benzo[d]imidazole, 1H-Benzimidazole, 2-(methylthio)-, 2-methylthiobenzimidazole, 2-(Methylsulfanyl)-1H-benzimidazole, S-Methyl-2-mercaptobenzimidazole, Benzimidazole, 2-(methylthio)-, 2-(methylthio)-1H-benzimidazole, 2-Methylthio benzimidazole, BENZIMIDAZOLE, 2-METHYLTHIO-, NSC 21699, 2-(Methylmercapto)benzimidazole, EINECS 230-494-5, UNII-3O1W4OYE3V, BRN 0122360, 3O1W4OYE3V, 2-methylsulfanyl-1H-benzimidazole, OCKJFOHZLXIAAT-UHFFFAOYSA-N, MFCD00005594, 2-(methylsulfanyl)-1H-1,3-benzodiazole, NSC21699, AC1L2MKB, Maybridge1_003491, Maybridge1_006291, ACMC-209oj2, 2-(methylthio)-benzimidazole, 5-23-11-00263 (Beilstein Handbook Reference), CHEMBL72355, SCHEMBL374735, AC1Q4H65, DTXSID2064577, CTK3I9495, HMS559F21, WLN: T56 BM DNJ CS1, ZINC81371, 2-(Methylthio)benzimidazole, 97%, 2-Methylsulfanyl-1H-benzoimidazole, KS-00000XA6, ANW-36060, BBL005572, NSC-21699, SBB045189, STK394299, AKOS000275364, CCG-102422, MCULE-3776014304, AJ-10552, DP 01217, LS-33075, ZB002893, DB-055542, ST2416218, TC-124805, BB 0219617, FT-0608856, H2914, M0438, ST45024628, AB00981269-01, AF-615/01049027, I01-18222, InChI=1/C8H8N2S/c1-11-8-9-6-4-2-3-5-7(6)10-8/h2-5H,1H3,(H,9,10, C8-H8-N2-S, CID23539, 1H-Benzimidazole, 2-(methylthio)- (9CI),

Complexity	140
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.041g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.226g/mol
Monoisotopic Mass	164.041g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	54A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Siginal words

Certificate of Analysis

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