2,6-Dichloro-4-(trifluoromethyl)pyridine

C6H2Cl2F3NCAS 39890-98-7215.98 g/mol

Open in Covalent MOL file
NClClFFF
Alkyl halideAryl halide

Properties

Molecular formula
C6H2Cl2F3N
Molar mass
215.98 g/mol
Exact mass
214.9516 Da
logP
3.41Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

Danger
Acute Toxic (GHS06)Irritant (GHS07)

Aggregated from 51 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
39890-98-7
SMILES
C1=C(C=C(N=C1Cl)Cl)C(F)(F)F
InChIKey
KVNQWVYYVLCZKK-UHFFFAOYSA-N
InChI
InChI=1S/C6H2Cl2F3N/c7-4-1-3(6(9,10)11)2-5(8)12-4/h1-2H

Weigh it out

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

Work with 2,6-Dichloro-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-Chloro-6-methyl-4-(trifluoromethyl)pyridine22123-14-470 % similar 2-Chloro-4-(trifluoromethyl)pyridine81565-18-657 % similar 2,4-Dichloro-6-(trifluoromethyl)pyrimidine16097-64-654 % similar 1,3,5-Tris(trifluoromethyl)benzene729-81-752 % similar 1-Chloro-3,5-bis(trifluoromethyl)benzene328-72-352 % similar 1,3-Dichloro-5-(trifluoromethyl)benzene54773-20-552 % similar 2-Chloro-4-iodo-6-(trifluoromethyl)pyridine205444-22-048 % similar 2-Chloro-6-(trifluoromethyl)pyridin-4-amine34486-22-148 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,6-Dichloro-3-(trifluoromethyl)pyridine55304-75-1 2,3-Dichloro-5-(trifluoromethyl)pyridine69045-84-7

Elsewhere

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