CAS
1611-92-3 Purity
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1611-92-3 Purity
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Specification
The molecular formula is C7H7BrO.
The molecular weight is 187.03 g/mol.
The IUPAC name is (2-bromophenyl)methanol.
The InChI is InChI=1S/C7H7BrO/c8-7-4-2-1-3-6(7)5-9/h1-4,9H,5H2.
The InChIKey is IOWGHQGLUMEZKG-UHFFFAOYSA-N.
The canonical SMILES is C1=CC=C(C(=C1)CO)Br.
The CAS number is 18982-54-2.
The European Community (EC) number is 242-719-4.
The UNII number is XH9B68J1KG.
Yes, 2-Bromobenzyl alcohol is canonicalized.