85006-23-1 Purity
98%
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Specification
The molecular formula of 4-(Acetylaminomethyl)benzeneboronic acid is C9H12BNO3.
The molecular weight of 4-(Acetylaminomethyl)benzeneboronic acid is 193.01 g/mol.
The IUPAC name of 4-(Acetylaminomethyl)benzeneboronic acid is [4-(acetamidomethyl)phenyl]boronic acid.
The InChI of 4-(Acetylaminomethyl)benzeneboronic acid is InChI=1S/C9H12BNO3/c1-7(12)11-6-8-2-4-9(5-3-8)10(13)14/h2-5,13-14H,6H2,1H3,(H,11,12).
The InChIKey of 4-(Acetylaminomethyl)benzeneboronic acid is ZMJVNKSOLIUBKO-UHFFFAOYSA-N.
The canonical SMILES of 4-(Acetylaminomethyl)benzeneboronic acid is B(C1=CC=C(C=C1)CNC(=O)C)(O)O.
The CAS number of 4-(Acetylaminomethyl)benzeneboronic acid is 850568-41-1.
The EC number of 4-(Acetylaminomethyl)benzeneboronic acid is 695-699-8.
Yes, 4-(Acetylaminomethyl)benzeneboronic acid is canonicalized.