2,4-Pyridinedicarbonitrile

C₇H₃N₃CAS 29181-50-8129.12 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₃N₃
Molar mass: 129.12 g/mol
Exact mass: 129.0327 Da
Melting point: 88–91 °C
logP: 0.82Crippen estimate
Polar surface area: 60.5 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 0

Identifiers

CAS number

29181-50-8

SMILES

N#Cc1ccnc(C#N)c1

InChIKey

HLAGQMFURMNTLW-UHFFFAOYSA-N

InChI

InChI=1S/C7H3N3/c8-4-6-1-2-10-7(3-6)5-9/h1-3H

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Names and synonyms

1 names

2,4-Dicyanopyridine

Work with 2,4-Pyridinedicarbonitrile

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-Bromo-4-cyanopyridine10386-27-359 % similar 4-Methyl-2-pyridinecarbonitrile1620-76-459 % similar 4-Chloro-2-cyanopyridine19235-89-359 % similar 2-Chloro-4-cyanopyridine33252-30-159 % similar 4-Bromo-2-pyridinecarbonitrile62150-45-259 % similar 4-Formyl-2-pyridinecarbonitrile131747-70-153 % similar 2-Cyanopyridine100-70-952 % similar 4-Cyanopyridine100-48-150 % similar

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

Same formula

2,6-Pyridinedicarbonitrile2893-33-6

Elsewhere

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