2,6-Dibromo-4-trifluoromethoxyaniline

C₇H₄Br₂F₃NOCAS 88149-49-9334.92 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Ether Primary amine

Properties

Molecular formula: C₇H₄Br₂F₃NO
Molar mass: 334.92 g/mol
Exact mass: 332.8612 Da
logP: 3.69Crippen estimate
Polar surface area: 35.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

88149-49-9

SMILES

Nc1c(Br)cc(OC(F)(F)F)cc1Br

InChIKey

JBSWOEGXMADXOU-UHFFFAOYSA-N

InChI

InChI=1S/C7H4Br2F3NO/c8-4-1-3(14-7(10,11)12)2-5(9)6(4)13/h1-2H,13H2

Weigh it out

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

Names and synonyms

2 names

Benzenamine, 2,6-dibromo-4-(trifluoromethoxy)-
2,6-Dibromo-4-(trifluoromethoxy)benzenamine

Work with 2,6-Dibromo-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-Bromo-4-trifluoromethoxyaniline175278-17-861 % similar 2,6-Dichloro-4-(trifluoromethoxy)benzenamine99479-66-056 % similar 2,6-Dibromo-4-fluoroaniline344-18-347 % similar 2,4,6-Tribromoaniline147-82-045 % similar 1-Bromo-4-(trifluoromethoxy)benzene407-14-744 % similar 4-(Trifluoromethoxy)aniline461-82-544 % similar 3-(Trifluoromethoxy)aniline1535-73-543 % similar 1-Bromo-3-(trifluoromethoxy)benzene2252-44-043 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook