2-Bromo-4-trifluoromethoxyaniline

C₇H₅BrF₃NOCAS 175278-17-8256.02 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Ether Primary amine

Properties

Molecular formula: C₇H₅BrF₃NO
Molar mass: 256.02 g/mol
Exact mass: 254.9507 Da
logP: 2.93Crippen estimate
Polar surface area: 35.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

175278-17-8

SMILES

Nc1ccc(OC(F)(F)F)cc1Br

InChIKey

ROSTYHNIIDIBEG-UHFFFAOYSA-N

InChI

InChI=1S/C7H5BrF3NO/c8-5-3-4(1-2-6(5)12)13-7(9,10)11/h1-3H,12H2

Weigh it out

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

Names and synonyms

3 names

Benzenamine, 2-bromo-4-(trifluoromethoxy)-
2-Bromo-4-(trifluoromethoxy)benzenamine
2-Bromo-4-(trifluoromethyloxy)aniline

Work with 2-Bromo-4-trifluoromethoxyaniline

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-Dibromo-4-trifluoromethoxyaniline88149-49-961 % similar 2-Fluoro-3-trifluoromethoxy aniline116369-23-457 % similar 2-Bromo-4-trifluoromethylaniline57946-63-151 % similar 1-Bromo-4-(trifluoromethoxy)benzene407-14-748 % similar 4-(Trifluoromethoxy)aniline461-82-548 % similar 3-(Trifluoromethoxy)aniline1535-73-547 % similar 1-Bromo-3-(trifluoromethoxy)benzene2252-44-047 % similar 2-Bromo-4-fluoroaniline1003-98-147 % similar

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

Same formula

5-Bromo-2-methoxy-3-(trifluoromethyl)pyridine1214377-42-0 3-Bromo-2-methoxy-5-(trifluoromethyl)pyridine124432-63-9

Elsewhere

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