3-Chloro-2-(trifluoromethyl)aniline

C₇H₅ClF₃NCAS 432-21-3195.57 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Primary amine

Properties

Molecular formula: C₇H₅ClF₃N
Molar mass: 195.57 g/mol
Exact mass: 195.0063 Da
logP: 2.94Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

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

432-21-3

SMILES

C1=CC(=C(C(=C1)Cl)C(F)(F)F)N

InChIKey

JYMNOYHOSWKVJU-UHFFFAOYSA-N

InChI

InChI=1S/C7H5ClF3N/c8-4-2-1-3-5(12)6(4)7(9,10)11/h1-3H,12H2

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Names and synonyms

1 names

2-Amino-6-chlorobenzotrifluoride

Work with 3-Chloro-2-(trifluoromethyl)aniline

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-benzotrifluoride104359-35-568 % similar 2-Amino-6-fluorobenzotrifluoride123973-22-860 % similar 2-Chloroaniline95-51-252 % similar 3-Chloro-2-fluorobenzenamine2106-04-950 % similar 2-Chloro-3-(trifluoromethyl)aniline62476-58-850 % similar 2,3-Dichloroaniline608-27-548 % similar 3-Chloro-5-(trifluoromethyl)-1,2-benzenediamine132915-80-147 % similar 2-Methyl-3-(trifluoromethyl)aniline54396-44-047 % similar

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

Same formula

2-Chloro-5-(trifluoromethyl)aniline121-50-6 2-Chloro-6-methyl-4-(trifluoromethyl)pyridine22123-14-4 4-Chloro-3-(trifluoromethyl)aniline320-51-4 5-(Chloromethyl)-2-(trifluoromethyl)pyridine386715-33-9 2-Chloro-4-trifluoromethylaniline39885-50-2 2-Chloro-6-(trifluoromethyl)benzenamine433-94-3 2-Trifluoromethyl-4-chloroaniline445-03-4 3-Chloro-4-trifluoromethylaniline445-13-6

Elsewhere

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