Boronic acid, (4-methyl-3-nitrophenyl)-


Chemical Name: Boronic acid, (4-methyl-3-nitrophenyl)-
CAS Number: 80500-27-2
Product Number: AG008MG1(AGN-PC-0KKVHP)
Synonyms:
MDL No:
Molecular Formula: C7H8BNO4
Molecular Weight: 180.9537

Identification/Properties


Computed Properties
Molecular Weight:
180.954g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
181.055g/mol
Monoisotopic Mass:
181.055g/mol
Topological Polar Surface Area:
86.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
193
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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