CAS
127827-52-5 Purity
96%
127827-52-5 Purity
96%
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The molecular formula is C8H8BrFO.
The molecular weight is 219.05 g/mol.
The IUPAC Name is 2-(bromomethyl)-4-fluoro-1-methoxybenzene.
The InChIKey is LXUGHXUXEMUEKR-UHFFFAOYSA-N.
The Canonical SMILES is COC1=C(C=C(C=C1)F)CBr.
The XLogP3-AA value is 2.6.
There are 2 hydrogen bond acceptors.
The exact mass is 217.97426 g/mol.
There are 11 heavy atoms.
Yes, the compound is canonicalized.