CAS
53087-13-1 Purity
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53087-13-1 Purity
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Specification
The molecular formula is C7H4BrF3O.
It was first created on July 19, 2005.
The IUPAC name is 1-bromo-2-(trifluoromethoxy)benzene.
The Canonical SMILES is C1=CC=C(C(=C1)OC(F)(F)F)Br.
The molecular weight is 241.00 g/mol.
It has 4 hydrogen bond acceptor counts.
The topological polar surface area is 9.2Ų.
Yes, it is considered a canonical compound.
The formal charge is 0.
It has 1 rotatable bond count.