2-(4-Chlorobenzyl)benzimidazole

C₁₄H₁₁ClN₂CAS 5468-66-6242.71 g/mol

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Properties

Molecular formula: C₁₄H₁₁ClN₂
Molar mass: 242.71 g/mol
Exact mass: 242.0611 Da
logP: 3.81Crippen estimate
Polar surface area: 28.7 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

5468-66-6

SMILES

C1=CC=C2C(=C1)NC(=N2)CC3=CC=C(C=C3)Cl

InChIKey

COGUOPIIFAMLES-UHFFFAOYSA-N

InChI

InChI=1S/C14H11ClN2/c15-11-7-5-10(6-8-11)9-14-16-12-3-1-2-4-13(12)17-14/h1-8H,9H2,(H,16,17)

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Names and synonyms

1 names

2-((4-Chlorophenyl)methyl)-1H-benzimidazole

Work with 2-(4-Chlorobenzyl)benzimidazole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dibazole621-72-772 % similar 2-(3,4-Dichlorobenzyl)-1H-benzo[d]imidazole213133-77-866 % similar 2-(Chloromethyl)benzimidazole4857-04-954 % similar 2-Ethylbenzimidazole1848-84-650 % similar 1H-Benzimidazole-2-methanol4856-97-750 % similar 2-Chlorobenzimidazole4857-06-149 % similar (4-Chlorophenyl)phenylmethane831-81-248 % similar 1H-Benzimidazole-2-acetonitrile4414-88-447 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-[2-(3-Chlorophenyl)ethyl]-2-pyridinecarbonitrile31255-57-9

Elsewhere

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