Boronic acid, 4-pyrimidinyl-


Chemical Name: Boronic acid, 4-pyrimidinyl-
CAS Number: 852362-24-4
Product Number: AG0038E5(AGN-PC-07R0FV)
Synonyms:
MDL No:
Molecular Formula: C4H5BN2O2
Molecular Weight: 123.9057

Identification/Properties


Computed Properties
Molecular Weight:
123.906g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
124.044g/mol
Monoisotopic Mass:
124.044g/mol
Topological Polar Surface Area:
66.2A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
90.6
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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