2-Phenylbenzimidazole

C₁₃H₁₀N₂CAS 716-79-0194.24 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₃H₁₀N₂
Molar mass: 194.24 g/mol
Exact mass: 194.0844 Da
Density: 1.06 g/mL (at 25 °C)
Melting point: 293 °C
logP: 3.23Crippen estimate
Polar surface area: 28.7 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed95.1% of notifiers
H315 Causes skin irritation95.1% of notifiers
H318 Causes serious eye damage95.1% of notifiers
H335 May cause respiratory irritation95.1% of notifiers

Aggregated from 41 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

716-79-0

SMILES

c1ccc(-c2nc3ccccc3[nH]2)cc1

InChIKey

DWYHDSLIWMUSOO-UHFFFAOYSA-N

InChI

InChI=1S/C13H10N2/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h1-9H,(H,14,15)

Weigh it out

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

Names and synonyms

11 names

1H-Benzimidazole, 2-phenyl-
Benzimidazole, 2-phenyl-
2-Phenyl-1H-benzimidazole
Phenzidole
Phenzidol
Phenizidole
Gainex
G 570
NSC 251956
2-Phenyl-1H-benzo[d]imidazole
2-Phenyl-1H-1,3-benzodiazole

Work with 2-Phenylbenzimidazole

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-(4-Pyridyl)benzimidazole2208-59-573 % similar 2-(4-Bromophenyl)-1H-benzimidazole2622-74-468 % similar 2,6-Bis(2-benzimidazolyl)pyridine28020-73-759 % similar Mercaptobenzimidazole583-39-159 % similar 6-Bromo-2-phenyl-1H-benzimidazole1741-50-058 % similar 2-Chlorobenzimidazole4857-06-154 % similar 2-Bromo-1H-benzimidazole54624-57-654 % similar 2-Methylbenzimidazole615-15-654 % similar

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

Same formula

Fluorenone hydrazone13629-22-6 5-Methyl-1,10-phenanthroline3002-78-6 2-Phenyl-2H-indazole3682-71-1 4-Amino-4'-cyanobiphenyl4854-84-6 α-Phenyl-2-pyridineacetonitrile5005-36-7 Diphenylcarbodiimide622-16-2 Diazodiphenylmethane883-40-9 9-Aminoacridine90-45-9

Elsewhere

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