Boronic acid, 1,3-benzodioxol-5-yl-


Chemical Name: Boronic acid, 1,3-benzodioxol-5-yl-
CAS Number: 94839-07-3
Product Number: AG0036VA(AGN-PC-07HAGU)
Synonyms:
MDL No:
Molecular Formula: C7H7BO4
Molecular Weight: 165.9391

Identification/Properties


Properties
MP:
224-229 °C(lit.)
BP:
347.3±52.0°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
165.939g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
166.044g/mol
Monoisotopic Mass:
166.044g/mol
Topological Polar Surface Area:
58.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
164
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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