4-Bromo-2-fluoro-6-(trifluoromethyl)benzenamine

C₇H₄BrF₄NCAS 875664-46-3258.01 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Primary amine

Properties

Molecular formula: C₇H₄BrF₄N
Molar mass: 258.01 g/mol
Exact mass: 256.9463 Da
logP: 3.19Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

875664-46-3

SMILES

Nc1c(F)cc(Br)cc1C(F)(F)F

InChIKey

FWIDRROZQFRPCM-UHFFFAOYSA-N

InChI

InChI=1S/C7H4BrF4N/c8-3-1-4(7(10,11)12)6(13)5(9)2-3/h1-2H,13H2

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

Names and synonyms

2 names

Benzenamine, 4-bromo-2-fluoro-6-(trifluoromethyl)-
4-Bromo-2-fluoro-6-(trifluoromethyl)aniline

Work with 4-Bromo-2-fluoro-6-(trifluoromethyl)benzenamine

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

2,4-Dibromo-6-fluoroaniline141474-37-556 % similar 5-Bromo-2-fluorobenzotrifluoride393-37-355 % similar 4-Bromo-2-(trifluoromethyl)aniline445-02-349 % similar 5-Bromo-3-(trifluoromethyl)pyridin-2-amine79456-34-146 % similar 4-Amino-2,5-difluorobenzotrifluoride114973-22-743 % similar 1,4-Dibromo-2-(trifluoromethyl)benzene7657-09-243 % similar 1,4-Dibromo-3,5-difluorobenzene128259-71-242 % similar 5-Bromo-1,2,3-trifluorobenzene138526-69-942 % similar

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

Same formula

4-Bromo-2-fluoro-5-(trifluoromethyl)benzenamine104460-70-0 2-Bromo-4-fluoro-6-(trifluoromethyl)benzenamine875664-27-0

Elsewhere

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