2-(2-Aminophenyl)benzimidazole

C₁₃H₁₁N₃CAS 5805-39-0209.25 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₁₃H₁₁N₃
Molar mass: 209.25 g/mol
Exact mass: 209.0953 Da
Melting point: 213–214 °C
logP: 2.81Crippen estimate
Polar surface area: 54.7 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage90.9% of notifiers
H319 Causes serious eye irritation11.4% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

5805-39-0

SMILES

Nc1ccccc1-c1nc2ccccc2[nH]1

InChIKey

YWNXHTNWOQHFRL-UHFFFAOYSA-N

InChI

InChI=1S/C13H11N3/c14-10-6-2-1-5-9(10)13-15-11-7-3-4-8-12(11)16-13/h1-8H,14H2,(H,15,16)

Weigh it out

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

Names and synonyms

11 names

Benzenamine, 2-(1H-benzimidazol-2-yl)-
Benzimidazole, 2-(o-aminophenyl)-
2-(1H-Benzimidazol-2-yl)benzenamine
2-(o-Aminophenyl)benzimidazole
G 620
G 620 (Amine)
2-(2-Aminophenyl)-1H-benzimidazole
2-[Benzimidazol-2-yl]benzenamine
2-(1H-Benzimidazol-2-yl)aniline
2-(1H-1,3-Benzodiazol-2-yl)aniline
2-(1H-Benzoimidazol-2-yl)-phenylamine

Work with 2-(2-Aminophenyl)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

Chlorfenazole3574-96-758 % similar 2-Phenylbenzimidazole716-79-052 % similar 2,6-Bis(2-benzimidazolyl)pyridine28020-73-750 % similar Mercaptobenzimidazole583-39-150 % similar 2-(4-Pyridyl)benzimidazole2208-59-547 % similar 2-(2′-Pyridyl)benzimidazole1137-68-446 % similar 2-Chlorobenzimidazole4857-06-145 % similar 2-Bromo-1H-benzimidazole54624-57-645 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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