CAS
95-56-7 Purity
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95-56-7 Purity
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The molecular formula is C10H12BrFO.
It was created on July 23, 2012.
The molecular weight is 247.10 g/mol.
The IUPAC name is 1-bromo-4-fluoro-2-methoxy-5-propan-2-ylbenzene.
The Canonical SMILES is CC(C)C1=CC(=C(C=C1F)OC)Br.
The InChIKey is CPPYOHQHPFTBON-UHFFFAOYSA-N.
It has two hydrogen bond acceptors.
The topological polar surface area is 9.2Ų.
Yes, the compound is canonicalized.
The exact mass is 246.00556 g/mol.