CAS
--- Purity
---
--- Purity
---
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula is C8H4BrF3O3.
The molecular weight is 285.01 g/mol.
The IUPAC name is 3-bromo-5-(trifluoromethoxy)benzoic acid.
The InChI is InChI=1S/C8H4BrF3O3/c9-5-1-4(7(13)14)2-6(3-5)15-8(10,11)12/h1-3H,(H,13,14).
The Canonical SMILES is C1=C(C=C(C=C1OC(F)(F)F)Br)C(=O)O.
The CAS number is 453565-90-7.
The European Community (EC) Number is 630-036-8.
There is 1 hydrogen bond donor count.
The topological polar surface area is 46.5Ų.
Yes, it is a canonicalized compound.