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Home > Boronic Acids > 24067-17-2
24067-17-2 | (4-Nitrophenyl)boronic acid
CAS No: 24067-17-2 Catalog No: AG003LWB MDL No:MFCD00161360
Product Description
Catalog Number:
AG003LWB
Chemical Name:
(4-Nitrophenyl)boronic acid
CAS Number:
24067-17-2
Molecular Formula:
C6H6BNO4
Molecular Weight:
166.9271
MDL Number:
MFCD00161360
IUPAC Name:
(4-nitrophenyl)boronic acid
InChI:
InChI=1S/C6H6BNO4/c9-7(10)5-1-3-6(4-2-5)8(11)12/h1-4,9-10H
InChI Key:
NSFJAFZHYOAMHL-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)[N+](=O)[O-])O
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.039g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
166.927g/mol
Monoisotopic Mass:
167.039g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.3A^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 |
| Discovery of boronic acids as novel and potent inhibitors of fatty acid amide hydrolase. | Journal of medicinal chemistry 20081127 |
| 3-Methoxycarbonyl-5-nitrophenyl boronic acid: high affinity diol recognition at neutral pH. | Bioorganic & medicinal chemistry letters 20040105 |
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