Chlorfenazole

C₁₃H₉ClN₂CAS 3574-96-7228.68 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₃H₉ClN₂
Molar mass: 228.68 g/mol
Exact mass: 228.0454 Da
Melting point: 234 °C
logP: 3.88Crippen estimate
Polar surface area: 28.7 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H318 Causes serious eye damage100% of notifiers

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, P501

Identifiers

CAS number

3574-96-7

SMILES

Clc1ccccc1-c1nc2ccccc2[nH]1

InChIKey

OILIYWFQRJOPAI-UHFFFAOYSA-N

InChI

InChI=1S/C13H9ClN2/c14-10-6-2-1-5-9(10)13-15-11-7-3-4-8-12(11)16-13/h1-8H,(H,15,16)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

10 names

1H-Benzimidazole, 2-(2-chlorophenyl)-
Benzimidazole, 2-(o-chlorophenyl)-
2-(2-Chlorophenyl)-1H-benzimidazole
2-(2-Chlorophenyl)benzimidazole
2-(2′-Chlorophenyl)benzimidazole
2-(o-Chlorophenyl)benzimidazole
G 572
NSC 128751
2-(2-Chlorophenyl)-1H-benzo[d]imidazole
2-(2-Chlorophenyl)-1H-1,3-benzodiazole

Work with Chlorfenazole

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

2-(2-Aminophenyl)benzimidazole5805-39-058 % similar 2,6-Bis(2-benzimidazolyl)pyridine28020-73-755 % similar 2-Chlorobenzimidazole4857-06-155 % similar 2-Phenylbenzimidazole716-79-052 % similar 2-(o-Chlorophenyl)-4,5-diphenylimidazole1707-67-151 % similar 2-(3,4-Dichlorobenzyl)-1H-benzo[d]imidazole213133-77-851 % similar Mercaptobenzimidazole583-39-150 % similar 2-(4-Pyridyl)benzimidazole2208-59-547 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook