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Home > Boronic Acids > 922730-47-0
922730-47-0 | Boronic acid, B-[2-(3,5-diphenyl-1H-pyrazol-1-yl)phenyl]-
CAS No: 922730-47-0 Catalog No: AG006LCN MDL No:
Product Description
Catalog Number:
AG006LCN
Chemical Name:
Boronic acid, B-[2-(3,5-diphenyl-1H-pyrazol-1-yl)phenyl]-
CAS Number:
922730-47-0
Molecular Formula:
C21H17BN2O2
Molecular Weight:
340.1829
IUPAC Name:
[2-(3,5-diphenylpyrazol-1-yl)phenyl]boronic acid
InChI:
InChI=1S/C21H17BN2O2/c25-22(26)18-13-7-8-14-20(18)24-21(17-11-5-2-6-12-17)15-19(23-24)16-9-3-1-4-10-16/h1-15,25-26H
InChI Key:
RQYREUSJGZXTID-UHFFFAOYSA-N
SMILES:
OB(c1ccccc1n1nc(cc1c1ccccc1)c1ccccc1)O
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.138g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
340.189g/mol
Monoisotopic Mass:
340.138g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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