CAS
741253-05-4 Purity
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741253-05-4 Purity
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The molecular formula is C7H8BBrO2.
The molecular weight is 214.85 g/mol.
It was created on March 30, 2010.
It was last modified on December 2, 2023.
The IUPAC name is (5-bromo-2-methylphenyl)boronic acid.
The InChI is InChI=1S/C7H8BBrO2/c1-5-2-3-6(9)4-7(5)8(10)11/h2-4,10-11H,1H3.
The InChIKey is QOZFXELTNKMOQP-UHFFFAOYSA-N.
The canonical SMILES is B(C1=C(C=CC(=C1)Br)C)(O)O.
The CAS number is 774608-13-8.
Yes, it is a canonicalized compound.