2-Chloro-3-cyano-4,6-dimethylpyridine

C₈H₇ClN₂CAS 14237-71-9166.61 g/mol

Open in Covalent MOL file

Aryl halide Nitrile

Properties

Molecular formula: C₈H₇ClN₂
Molar mass: 166.61 g/mol
Exact mass: 166.0298 Da
logP: 2.22Crippen estimate
Polar surface area: 36.7 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

14237-71-9

SMILES

CC1=CC(=NC(=C1C#N)Cl)C

InChIKey

RETJKTAVEQPNMH-UHFFFAOYSA-N

InChI

InChI=1S/C8H7ClN2/c1-5-3-6(2)11-8(9)7(5)4-10/h3H,1-2H3

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Names and synonyms

1 names

2-Chloro-4,6-dimethyl-3-pyridinecarbonitrile

Work with 2-Chloro-3-cyano-4,6-dimethylpyridine

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-Dichloro-4-methyl-3-pyridinecarbonitrile875-35-470 % similar 2-Mercapto-4,6-dimethylnicotinonitrile54585-47-660 % similar 3-Cyano-4,6-dimethyl-2-hydroxypyridine769-28-860 % similar 2-Chloro-4-methyl-3-pyridinecarbonitrile65169-38-253 % similar 2-Chloro-6-methylbenzonitrile6575-09-344 % similar 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-3-pyridinecarbonitrile5444-02-044 % similar 2,5-Dichloro-4,6-dimethyl-3-pyridinecarbonitrile91591-63-844 % similar 4-Hydroxy-2,6-dimethylbenzonitrile58537-99-843 % similar

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

Same formula

4-Amino-3-chloro-5-methylbenzonitrile158296-69-6 5-Chloro-2-methylbenzimidazole2818-69-1 2-(Chloromethyl)benzimidazole4857-04-9 4-Chloro-3-methyl-1H-pyrrolo[2,3-B]pyridine688782-02-7

Elsewhere

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