2-Chloro-4,5,7-trimethylquinoline

C₁₂H₁₂ClNCAS 329210-71-1205.69 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₂ClN
Molar mass: 205.69 g/mol
Exact mass: 205.0658 Da
logP: 3.81Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

329210-71-1

SMILES

CC1=CC(=C2C(=CC(=NC2=C1)Cl)C)C

InChIKey

LPTKXGDEXQXRMU-UHFFFAOYSA-N

InChI

InChI=1S/C12H12ClN/c1-7-4-8(2)12-9(3)6-11(13)14-10(12)5-7/h4-6H,1-3H3

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Names and synonyms

1 names

Mfcd00760268

Work with 2-Chloro-4,5,7-trimethylquinoline

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-methylpyridine39621-00-654 % similar 2-Chloro-4-methylquinoline634-47-949 % similar 2-Chloro-4,6-dimethylpyridine30838-93-847 % similar 6-Chloro-4-methyl-2-pyridinamine51564-92-244 % similar 2-Chloromesitylene1667-04-543 % similar 2-Chloro-6-methylquinoline4295-11-841 % similar Iodomesitylene4028-63-140 % similar 4,6-Dichloro-2-methylpyrimidine1780-26-339 % similar

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

Same formula

Diphenylammonium chloride537-67-7

Elsewhere

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