4-Chloro-6-fluoro-2-(trifluoromethyl)quinoline

C₁₀H₄ClF₄NCAS 59611-55-1249.59 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₁₀H₄ClF₄N
Molar mass: 249.59 g/mol
Exact mass: 248.9968 Da
logP: 4.05Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

59611-55-1

SMILES

Fc1ccc2nc(C(F)(F)F)cc(Cl)c2c1

InChIKey

BLIVSENQFPJREV-UHFFFAOYSA-N

InChI

InChI=1S/C10H4ClF4N/c11-7-4-9(10(13,14)15)16-8-2-1-5(12)3-6(7)8/h1-4H

Weigh it out

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

Names and synonyms

2 names

Quinoline, 4-chloro-6-fluoro-2-(trifluoromethyl)-
4-Chloro-6-fluoro-2-trifluoromethylquinoline

Work with 4-Chloro-6-fluoro-2-(trifluoromethyl)quinoline

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

4-Chloro-6-methyl-2-(trifluoromethyl)quinoline1701-26-467 % similar 6-(Bromomethyl)-4-chloro-2-(trifluoromethyl)-quinoline123637-51-462 % similar 4-Chloro-6-fluoro-2-methylquinoline18529-01-659 % similar 4,5,7-Trichloro-2-(trifluoromethyl)quinoline175203-41-550 % similar 4-Chloro-2,8-bis(trifluoromethyl)quinoline83012-13-950 % similar 1-Chloro-4-fluoro-2-(trifluoromethyl)benzene89634-75-347 % similar 4-Chloro-6-methyl-5-nitro-2-(trifluoromethyl)quinoline175203-61-944 % similar 6-Methyl-2-(trifluoromethyl)-4-quinolinol1701-20-841 % similar

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

Elsewhere

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