Name: Name:1H-Benzimidazole-2-acetonitrile,4-methyl-(9CI)
Brand: Angene
SKU: AG00DWH1
Rating: 90 (10 reviews)

1H-Benzimidazole-2-acetonitrile,4-methyl-(9CI)

CAS No.:

55025-38-2

Catalog Number:

AG00DWH1

Molecular Formula:

C10H9N3

Molecular Weight:

171.1986

Catalog Number:

AG00DWH1

Chemical Name:

1H-Benzimidazole-2-acetonitrile,4-methyl-(9CI)

CAS Number:

55025-38-2

Molecular Formula:

C10H9N3

Molecular Weight:

171.1986

MDL Number:

MFCD05722264

IUPAC Name:

2-(4-methyl-1H-benzimidazol-2-yl)acetonitrile

InChI:

InChI=1S/C10H9N3/c1-7-3-2-4-8-10(7)13-9(12-8)5-6-11/h2-4H,5H2,1H3,(H,12,13)

InChI Key:

XSQOQQAZUCYJKU-UHFFFAOYSA-N

SMILES:

N#CCc1nc2c([nH]1)cccc2C

Complexity:

230

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

171.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

171.203g/mol

Monoisotopic Mass:

171.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5