2-Chloro-6-methyl-4-(trifluoromethyl)pyridine

C₇H₅ClF₃NCAS 22123-14-4195.57 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₇H₅ClF₃N
Molar mass: 195.57 g/mol
Exact mass: 195.0063 Da
logP: 3.06Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Warning

H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled78.3% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled13% of notifiers
H335 May cause respiratory irritation95.7% of notifiers

Aggregated from 23 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

22123-14-4

SMILES

Cc1cc(C(F)(F)F)cc(Cl)n1

InChIKey

SXLBWNSGCIEART-UHFFFAOYSA-N

InChI

InChI=1S/C7H5ClF3N/c1-4-2-5(7(9,10)11)3-6(8)12-4/h2-3H,1H3

Weigh it out

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

Names and synonyms

2 names

Pyridine, 2-chloro-6-methyl-4-(trifluoromethyl)-
2-Chloro-4-trifluoromethyl-6-methylpyridine

Work with 2-Chloro-6-methyl-4-(trifluoromethyl)pyridine

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-(trifluoromethyl)pyridine39890-98-770 % similar 2-Chloro-4,6-dimethylpyridine30838-93-852 % similar 2,4-Dichloro-6-methylpyridine42779-56-652 % similar 2-Chloro-6-methylpyridin-4-amine79055-63-348 % similar 2,4-Dichloro-6-methylpyrimidine5424-21-548 % similar 4-Chloro-2-methyl-7-(trifluoromethyl)quinoline18529-09-448 % similar 2-Chloro-4-(trifluoromethyl)pyridine81565-18-647 % similar 4-Chloro-2,6-dimethylpyrimidine4472-45-147 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Chloro-5-(trifluoromethyl)aniline121-50-6 4-Chloro-3-(trifluoromethyl)aniline320-51-4 5-(Chloromethyl)-2-(trifluoromethyl)pyridine386715-33-9 2-Chloro-4-trifluoromethylaniline39885-50-2 3-Chloro-2-(trifluoromethyl)aniline432-21-3 2-Chloro-6-(trifluoromethyl)benzenamine433-94-3 2-Trifluoromethyl-4-chloroaniline445-03-4 3-Chloro-4-trifluoromethylaniline445-13-6

Elsewhere

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