135795-51-6 Purity
96%
If you have any other questions or need other size, please get a quote.
The molecular formula of 4-Bromo-3-(trifluoromethyl)benzoic acid is C8H4BrF3O2.
The molecular weight of 4-Bromo-3-(trifluoromethyl)benzoic acid is 269.01 g/mol.
The IUPAC name of 4-Bromo-3-(trifluoromethyl)benzoic acid is 4-bromo-3-(trifluoromethyl)benzoic acid.
The InChI of 4-Bromo-3-(trifluoromethyl)benzoic acid is InChI=1S/C8H4BrF3O2/c9-6-2-1-4(7(13)14)3-5(6)8(10,11)12/h1-3H,(H,13,14).
The InChIKey of 4-Bromo-3-(trifluoromethyl)benzoic acid is GPBPFDPENZHCPR-UHFFFAOYSA-N.
The canonical SMILES of 4-Bromo-3-(trifluoromethyl)benzoic acid is C1=CC(=C(C=C1C(=O)O)C(F)(F)F)Br.
The CAS number of 4-Bromo-3-(trifluoromethyl)benzoic acid is 161622-14-6.
The EC number of 4-Bromo-3-(trifluoromethyl)benzoic acid is 630-304-4.
The XLogP3-AA value of 4-Bromo-3-(trifluoromethyl)benzoic acid is 3.
Yes, 4-Bromo-3-(trifluoromethyl)benzoic acid is a canonicalized compound.