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Home > Boronic Acids > 1310383-92-6
1310383-92-6 | Pyrazole-3-boronic Acid Hydrate
CAS No: 1310383-92-6 Catalog No: AG01ENEB MDL No:
Product Description
Catalog Number:
AG01ENEB
Chemical Name:
Pyrazole-3-boronic Acid Hydrate
CAS Number:
1310383-92-6
IUPAC Name:
1H-pyrazol-5-ylboronic acid;hydrate
InChI:
InChI=1S/C3H5BN2O2.H2O/c7-4(8)3-1-2-5-6-3;/h1-2,7-8H,(H,5,6);1H2
InChI Key:
NXQCQMBEFQLICU-UHFFFAOYSA-N
Properties
Complexity:
79.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.055g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
129.91g/mol
Monoisotopic Mass:
130.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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