Home Boronic acids (4-Hydroxy-3-nitrophenyl)boronic acid

(4-Hydroxy-3-nitrophenyl)boronic acid

CAS No.:
850568-75-1
Catalog Number:
AG004YHZ
Molecular Formula:
C6H6BNO5
Molecular Weight:
182.9265
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Product Description
Catalog Number:
AG004YHZ
Chemical Name:
(4-Hydroxy-3-nitrophenyl)boronic acid
CAS Number:
850568-75-1
Molecular Formula:
C6H6BNO5
Molecular Weight:
182.9265
MDL Number:
MFCD06659843
IUPAC Name:
(4-hydroxy-3-nitrophenyl)boronic acid
InChI:
InChI=1S/C6H6BNO5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9-11H
InChI Key:
GEQDFOXXEZKEPZ-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)[N+](=O)[O-])O)O
Properties
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.034g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
182.926g/mol
Monoisotopic Mass:
183.034g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties