1H-pyrazol-4-ylboronic acid;hydrochloride


Chemical Name: 1H-pyrazol-4-ylboronic acid;hydrochloride
CAS Number: 1256346-38-9
Product Number: AG000O2A(AGN-PC-09PZ0V)
Synonyms:
MDL No:
Molecular Formula: C3H6BClN2O2
Molecular Weight: 148.3559

Identification/Properties


Computed Properties
Molecular Weight:
148.353g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
148.021g/mol
Monoisotopic Mass:
148.021g/mol
Topological Polar Surface Area:
69.1A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
79.7
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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