4-Cyanobenzamide

C₈H₆N₂OCAS 3034-34-2146.15 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₆N₂O
Molar mass: 146.15 g/mol
Exact mass: 146.0480 Da
Melting point: 224 °C
logP: 0.66Crippen estimate
Polar surface area: 66.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

3034-34-2

SMILES

N#Cc1ccc(C(N)=O)cc1

InChIKey

FUKWTMJZHKZKFA-UHFFFAOYSA-N

InChI

InChI=1S/C8H6N2O/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H2,10,11)

Weigh it out

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

Names and synonyms

4 names

Benzamide, 4-cyano-
Benzamide, p-cyano-
p-Cyanobenzamide
4-Carbamoylbenzonitrile

Work with 4-Cyanobenzamide

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

Imidazo[1,2-A]pyridine-6-carbaldehyde116355-16-9 Imidazo(1,2-a)pyridine-2-carbaldehyde118000-43-4 1(2H)-Phthalazinone119-39-1 2(1H)-Quinoxalinone1196-57-2 2-Cyanobenzamide17174-98-0 1H-Benzimidazole-2-carboxaldehyde3314-30-5 Quinazolinone491-36-1 β-Oxo-2-pyridinepropanenitrile54123-21-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook