2-(Cyanomethyl)-4-methylbenzimidazole - CAS 55025-38-2

Catalog:	BB028888
Product Name:	2-(Cyanomethyl)-4-methylbenzimidazole
CAS:	55025-38-2
Synonyms:	2-(4-methyl-1H-benzimidazol-2-yl)acetonitrile; 2-(4-methyl-1H-benzimidazol-2-yl)acetonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	2-(4-methyl-1H-benzimidazol-2-yl)acetonitrile
Description:	2-(Cyanomethyl)-4-methylbenzimidazole (CAS# 55025-38-2) is a useful research chemical.
Molecular Weight:	171.20
Molecular Formula:	C10H9N3
Canonical SMILES:	CC1=C2C(=CC=C1)NC(=N2)CC#N
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
LogP:	1.93738

Publication Number	Title	Priority Date
CA-2474850-A1	Imidazo[1,2-a]pyridine derivatives	20020131
EP-1479681-A1	IMIDAZO(1,2-a)PYRIDINE DERIVATIVE	20020131
JP-WO2003064422-A1	Imidazo [1,2-a] pyridine derivatives	20020131
KR-20040077920-A	Imidazo[1,2-a]pyridine derivative	20020131
TW-200306822-A	Imidazo[1, 2-a]pyridine derivative	20020131

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Related Functional Groups

Nitrogen Compounds

[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[1243387-55-4]
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene
[13021-14-2]
2,4,6-Trimethyl-N-methylaniline
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid
[2241982-86-3]
3-(Phenyl-2-D)propanenitrile-2,2-D2

Complexity:	230
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.0796473
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	171.0796473
Rotatable Bond Count:	1
Topological Polar Surface Area:	52.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5