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Home > Boronic Acids > 204841-19-0
204841-19-0 | Boronic acid, B-(3-acetylphenyl)-
CAS No: 204841-19-0 Catalog No: AG0029Q5 MDL No:MFCD01074678
Product Description
Catalog Number:
AG0029Q5
Chemical Name:
Boronic acid, B-(3-acetylphenyl)-
CAS Number:
204841-19-0
Molecular Formula:
C8H9BO3
Molecular Weight:
163.9663
MDL Number:
MFCD01074678
IUPAC Name:
(3-acetylphenyl)boronic acid
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
SMILES:
OB(c1cccc(c1)C(=O)C)O
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.064g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
163.967g/mol
Monoisotopic Mass:
164.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Metal-free carbon-carbon bond-forming reductive coupling between boronic acids and tosylhydrazones. | Nature chemistry 20090901 |
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