2,1,3-benzoxadiazol-5-ylboronic acid


Chemical Name: 2,1,3-benzoxadiazol-5-ylboronic acid
CAS Number: 426268-09-9
Product Number: AG00C76V(AGN-PC-0LF7R8)
Synonyms:
MDL No:
Molecular Formula: C6H5BN2O3
Molecular Weight: 163.9265

Identification/Properties


Properties
BP:
374.7°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
163.927g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
164.039g/mol
Monoisotopic Mass:
164.039g/mol
Topological Polar Surface Area:
79.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
169
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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