4-Chloro-2-(trifluoromethyl)benzylamine

C₈H₇ClF₃NCAS 771583-81-4209.60 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Primary amine

Properties

Molecular formula: C₈H₇ClF₃N
Molar mass: 209.60 g/mol
Exact mass: 209.0219 Da
logP: 2.82Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

771583-81-4

SMILES

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

InChIKey

VPKIGWHSTBKRTA-UHFFFAOYSA-N

InChI

InChI=1S/C8H7ClF3N/c9-6-2-1-5(4-13)7(3-6)8(10,11)12/h1-3H,4,13H2

Weigh it out

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Work with 4-Chloro-2-(trifluoromethyl)benzylamine

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-Fluoro-2-(trifluoromethyl)phenyl)methanamine202522-22-362 % similar 4-Chloro-1-iodo-2-(trifluoromethyl)benzene23399-77-156 % similar 2-Trifluoromethyl-4-chloroaniline445-03-456 % similar 4-Chloro-2-fluorobenzylamine72235-57-556 % similar 2-(Trifluoromethyl)benzenemethanamine3048-01-955 % similar 1,4-Dichloro-2-(trifluoromethyl)benzene320-50-355 % similar 2,4-Dichlorobenzenemethanamine95-00-155 % similar 4-Chloro-1-fluoro-2-(trifluoromethyl)benzene89634-74-253 % similar

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

Same formula

3-Chloro-4-(trifluoromethyl)benzyl amine361393-93-3 2-Chloro-3-(trifluoromethyl)benzylamine39226-96-5 4-Chloro-3-(trifluoromethyl)benzylamine62039-92-3

Elsewhere

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