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

C5HCl2F3N2CAS 16097-64-6216.97 g/mol

Open in Covalent MOL file
NNClClFFF
Alkyl halideAryl halide

Properties

Molecular formula
C5HCl2F3N2
Molar mass
216.97 g/mol
Exact mass
215.9469 Da
logP
2.80Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
16097-64-6
SMILES
C1=C(N=C(N=C1Cl)Cl)C(F)(F)F
InChIKey
ZTNFYAJHLPMNSN-UHFFFAOYSA-N
InChI
InChI=1S/C5HCl2F3N2/c6-3-1-2(5(8,9)10)11-4(7)12-3/h1H

Weigh it out

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

Work with 2,4-Dichloro-6-(trifluoromethyl)pyrimidine

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-2-(methylsulfanyl)-6-(trifluoromethyl)pyrimidine16097-63-559 % similar 2-Chloro-4-iodo-6-(trifluoromethyl)pyridine205444-22-058 % similar 2-Chloro-6-(trifluoromethyl)pyridin-4-amine34486-22-158 % similar 4-Chloro-2-(pyridin-4-yl)-6-(trifluoromethyl)pyrimidine204394-70-754 % similar 2,4,6-Trichloropyrimidine3764-01-054 % similar 2,6-Dichloro-4-(trifluoromethyl)pyridine39890-98-754 % similar 4-Chloro-6-trifluoromethylpyrimidine37552-81-153 % similar 2-Chloro-6-(trifluoromethyl)isonicotinonitrile1196155-38-053 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,4-Dichloro-5-(trifluoromethyl)pyrimidine3932-97-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook