4-Chloro-3-(trifluoromethyl)pyridine hydrochloride

C₆H₄Cl₂F₃NCAS 732306-24-0218.00 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₆H₄Cl₂F₃N
Molar mass: 218.00 g/mol
Exact mass: 216.9673 Da
logP: 3.18Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation97.7% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number

732306-24-0

SMILES

C1=CN=CC(=C1Cl)C(F)(F)F.Cl

InChIKey

HCKXJUZITVCDND-UHFFFAOYSA-N

InChI

InChI=1S/C6H3ClF3N.ClH/c7-5-1-2-11-3-4(5)6(8,9)10;/h1-3H;1H

Weigh it out

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

Work with 4-Chloro-3-(trifluoromethyl)pyridine hydrochloride

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

3-Chloro-4-(trifluoromethyl)pyridine81565-19-765 % similar 4-Chloro-3-fluoropyridine hcl119229-74-255 % similar 3-Bromo-4-chloropyridine hydrochloride181256-18-850 % similar 4-Chloro-3-methylpyridine hydrochloride19524-08-450 % similar 3-Fluoro-4-(trifluoromethyl)pyridine113770-87-947 % similar 2-Chlorobenzotrifluoride88-16-447 % similar 3,4-Dichloropyridine55934-00-447 % similar 3-Amino-4-(trifluoromethyl)pyridine175204-80-546 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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