4-Formyl-2-pyridinecarbonitrile

C₇H₄N₂OCAS 131747-70-1132.12 g/mol

Open in Covalent MOL file

Aldehyde Nitrile

Properties

Molecular formula: C₇H₄N₂O
Molar mass: 132.12 g/mol
Exact mass: 132.0324 Da
logP: 0.77Crippen estimate
Polar surface area: 53.8 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

131747-70-1

SMILES

N#Cc1cc(C=O)ccn1

InChIKey

JAJMFFPLHLWYJQ-UHFFFAOYSA-N

InChI

InChI=1S/C7H4N2O/c8-4-7-3-6(5-10)1-2-9-7/h1-3,5H

Weigh it out

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

Names and synonyms

3 names

2-Pyridinecarbonitrile, 4-formyl-
2-Cyanopyridine-4-carboxaldehyde
4-Formylpyridine-2-carbonitrile

Work with 4-Formyl-2-pyridinecarbonitrile

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-Pyridinedicarbonitrile29181-50-853 % similar 2-Chloro-4-pyridinecarboxaldehyde101066-61-950 % similar 2-Bromo-4-pyridinecarboxaldehyde118289-17-150 % similar 4-Methyl-2-pyridinecarbonitrile1620-76-450 % similar 4-Chloro-2-cyanopyridine19235-89-350 % similar 4-Bromo-2-pyridinecarbonitrile62150-45-250 % similar 3-Cyanobenzaldehyde24964-64-549 % similar 4-Cyanobenzaldehyde105-07-745 % similar

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

Elsewhere

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