AG00C3VU

221636-18-6 | 5-BROMO-1-PHENYL-1H-BENZOIMIDAZOLE

AG00C3VU

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CAS Number	221636-18-6
Catalog Number	AG00C3VU(AGN-PC-00JQG1)
Chemical Name	5-BROMO-1-PHENYL-1H-BENZOIMIDAZOLE
IUPAC Name	5-bromo-1-phenylbenzimidazole
InChI	InChI=1S/C13H9BrN2/c14-10-6-7-13-12(8-10)15-9-16(13)11-4-2-1-3-5-11/h1-9H
InChI Key	OCVMHOYOAZUGSK-UHFFFAOYSA-N
MDL Number	MFCD05864728
Molecular Formula	C13H9BrN2
Molecular Weight	273.1280
SMILES	BrC1=CC=C2N(C3=CC=CC=C3)C=NC2=C1
Synonyms	5-Bromo-1-phenyl-1H-benzoimidazole, 221636-18-6, 5-bromo-1-phenyl-1h-benzo[d]imidazole, AK-16613, SCHEMBL1129240, CHEMBL3902643, DTXSID00475895, OCVMHOYOAZUGSK-UHFFFAOYSA-N, 1-Phenyl-5-bromo-1H-benzimidazole, KS-00000F1T, ZINC2563752, 5-bromo-1-phenyl-1,3-benzodiazole, ANW-75328, MFCD05864728, AKOS015835904, DS-9103, RP29677, 5-bromo-1-phenyl-1H-1,3-benzodiazole, ACM221636186, AJ-40869, BR-16613, AB0023502, AX8102566, DB-001900, TR-010435, 4CH-006553, FT-0763397, ST24032908, W4573, S-3310, J-516820, I14-15886, C13H9BrN2,

Complexity	240
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	271.995g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	273.133g/mol
Monoisotopic Mass	271.995g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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