chempirical

1H-Benzimidazole-6-carboxaldehyde

C8H6N2OCAS 58442-17-4146.15 g/mol

Open in Covalent MOL file
ONNH
Aldehyde

Properties

Molecular formula
C8H6N2O
Molar mass
146.15 g/mol
Exact mass
146.0480 Da
Melting point
163–165 °C
logP
1.38Crippen estimate
Polar surface area
45.8 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
58442-17-4
SMILES
O=Cc1ccc2nc[nH]c2c1
InChIKey
ALCHVVTYAHQOFY-UHFFFAOYSA-N
InChI
InChI=1S/C8H6N2O/c11-4-6-1-2-7-8(3-6)10-5-9-7/h1-5H,(H,9,10)

Weigh it out

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

Names and synonyms

6 names
  • 1H-Benzimidazole-5-carboxaldehyde
  • Benzimidazole-6-carboxaldehyde
  • Benzimidazole-5-carboxaldehyde
  • 1H-Benzo[d]imidazole-5-carbaldehyde
  • 1H-1,3-Benzodiazole-6-carbaldehyde
  • 1H-1,3-Benzodiazole-5-carbaldehyde

Work with 1H-Benzimidazole-6-carboxaldehyde

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

Same formula

1(2H)-Phthalazinone119-39-1 2(1H)-Quinoxalinone1196-57-2 2-Cyanobenzamide17174-98-0 4-Cyanobenzamide3034-34-2 1H-Benzimidazole-2-carboxaldehyde3314-30-5 Quinazolinone491-36-1 β-Oxo-2-pyridinepropanenitrile54123-21-6 1H-Indazole-4-carboxaldehyde669050-70-8

Elsewhere

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