Benzeneacetic acid, 4-borono-


Chemical Name: Benzeneacetic acid, 4-borono-
CAS Number: 90111-58-3
Product Number: AG00GT0K(AGN-PC-03H38G)
Synonyms:
MDL No:
Molecular Formula: C8H9BO4
Molecular Weight: 179.9657

Identification/Properties


Computed Properties
Molecular Weight:
179.966g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
180.059g/mol
Monoisotopic Mass:
180.059g/mol
Topological Polar Surface Area:
77.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
175
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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