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Home Boronic acids 4-Acetylphenylboronic acid

4-Acetylphenylboronic acid

CAS No.:
149104-90-5
Catalog Number:
AG001LE0
Molecular Formula:
C8H9BO3
Molecular Weight:
163.9663
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$15
- +
25g
98%
In Stock USA
United States
$57
- +
100g
98%
In Stock USA
United States
$220
- +
Product Description
Catalog Number:
AG001LE0
Chemical Name:
4-Acetylphenylboronic acid
CAS Number:
149104-90-5
Molecular Formula:
C8H9BO3
Molecular Weight:
163.9663
MDL Number:
MFCD01074667
IUPAC Name:
(4-acetylphenyl)boronic acid
InChI:
InChI=1S/C8H9BO3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5,11-12H,1H3
InChI Key:
OBQRODBYVNIZJU-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)C(=O)C)O
Properties
Complexity:
162  
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
Aryl boronic acid inhibition of synthetic melanin polymerization. Bioorganic & medicinal chemistry letters 20100801
Direct oxidation of boronates by peroxynitrite: mechanism and implications in fluorescence imaging of peroxynitrite. Free radical biology & medicine 20091115
Properties