6-Chloro-4-methyl-3-pyridinecarbonitrile

C₇H₅ClN₂CAS 66909-35-1152.58 g/mol

Open in Covalent MOL file

Aryl halide Nitrile

Properties

Molecular formula: C₇H₅ClN₂
Molar mass: 152.58 g/mol
Exact mass: 152.0141 Da
Melting point: 108–109 °C
logP: 1.92Crippen estimate
Polar surface area: 36.7 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

66909-35-1

SMILES

Cc1cc(Cl)ncc1C#N

InChIKey

DWLWCFHFMYBZKE-UHFFFAOYSA-N

InChI

InChI=1S/C7H5ClN2/c1-5-2-7(8)10-4-6(5)3-9/h2,4H,1H3

Weigh it out

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

Names and synonyms

4 names

3-Pyridinecarbonitrile, 6-chloro-4-methyl-
2-Chloro-4-methyl-5-pyridinecarbonitrile
6-Chloro-4-methylpyridine-3-carbonitrile
6-Chloro-4-methylnicotinonitrile

Work with 6-Chloro-4-methyl-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-Bromo-5-cyano-4-picoline1003711-35-059 % similar 6-Chloro-4-methyl-3-pyridinamine66909-38-450 % similar 2,6-Dichloro-4-methyl-3-pyridinecarbonitrile875-35-449 % similar 4-Chloro-2-methylbenzonitrile50712-68-049 % similar B-(6-Chloro-4-methyl-3-pyridinyl)boronic acid913836-08-546 % similar 4-Methyl-3-pyridinecarbonitrile5444-01-946 % similar 2-Chloro-5-methyl-4-pyridinamine79055-62-246 % similar 2,4-Dimethylbenzonitrile21789-36-643 % similar

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

Same formula

2-Chloro-3-pyridineacetonitrile101012-32-2 6-Chloro-1H-pyrrolo[3,2-B]pyridine1021339-19-4 4-Chloro (1H)indazole13096-96-3 5-Chloro-1H-pyrrolo[2,3-C]pyridine131084-55-4 6-Chloromethyl-2-cyanopyridine135450-23-6 4-Amino-2-chlorobenzonitrile20925-27-3 3-Chloroindazole29110-74-5 7-Chloro-1H-pyrrolo[2,3-C]pyridine357263-41-3

Elsewhere

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