2-Chloro-6-phenyl-3-pyridinecarbonitrile

C₁₂H₇ClN₂CAS 43083-14-3214.65 g/mol

Open in Covalent MOL file

Aryl halide Nitrile

Properties

Molecular formula: C₁₂H₇ClN₂
Molar mass: 214.65 g/mol
Exact mass: 214.0298 Da
Melting point: 112–114 °C
logP: 3.27Crippen estimate
Polar surface area: 36.7 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Identifiers

CAS number

43083-14-3

SMILES

N#Cc1ccc(-c2ccccc2)nc1Cl

InChIKey

NROZOMIVAHCNED-UHFFFAOYSA-N

InChI

InChI=1S/C12H7ClN2/c13-12-10(8-14)6-7-11(15-12)9-4-2-1-3-5-9/h1-7H

Weigh it out

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

Names and synonyms

4 names

3-Pyridinecarbonitrile, 2-chloro-6-phenyl-
2-Chloro-3-cyano-6-phenylpyridine
NSC 363888
2-Chloro-6-phenylnicotinonitrile

Work with 2-Chloro-6-phenyl-3-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

2,6-Diphenylpyridine3558-69-847 % similar 3-Chloropyridazine-4-carbonitrile1445-56-344 % similar 2,6-Pyridinedicarbonitrile2893-33-641 % similar 3-Chloro-6-phenylpyridazine20375-65-939 % similar 6-Chloro-2-pyridinecarbonitrile33252-29-839 % similar 2-Bromo-6-phenylpyridine39774-26-039 % similar 2-Phenylquinoline612-96-439 % similar 4-Chloro-2-phenylquinazoline6484-25-938 % similar

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

Same formula

5-Chloro-1,10-phenanthroline4199-89-7 2-Chloro-1,10-phenanthroline7089-68-1

Elsewhere

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