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Structure

3-Acetylphenylboronic acid

CAS
204841-19-0
Catalog Number
ACM204841190
Category
Boronic Acids
Molecular Weight
163.97g/mol
Molecular Formula
C8H9BO3

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Specification

Synonyms
RARECHEM AH PB 0163;TIMTEC-BB SBB000147;M-ACETYLPHENYLBORONIC ACID;3-ACETYLBENZENEBORONIC ACID;3-ACETYLPHENYLBORONIC ACID;ACETOPHENONE-3-BORONIC ACID;AKOS BRN-0025;3-Acetylphenylboronic acid~3-Boronoacetophenone
IUPAC Name
(3-acetylphenyl)boronic acid
Canonical SMILES
B(C1=CC(=CC=C1)C(=O)C)(O)O
InChI
InChI=1S/C8H9BO3/c1-6(10)7-3-2-4-8(5-7)9(11)12/h2-5,11-12H,1H3
InChI Key
SJGGDZCTGBKBCK-UHFFFAOYSA-N
Complexity
170
Covalently-Bonded Unit Count
1
Exact Mass
164.064474g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
2
Heavy Atom Count
12
Monoisotopic Mass
164.064474g/mol
Rotatable Bond Count
2
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