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Home > Boronic Acids > 1025496-32-5
1025496-32-5 | Boronic acid, B-(3'-chloro[1,1'-biphenyl]-4-yl)-
CAS No: 1025496-32-5 Catalog No: AG0007OL MDL No:
Product Description
Catalog Number:
AG0007OL
Chemical Name:
Boronic acid, B-(3'-chloro[1,1'-biphenyl]-4-yl)-
CAS Number:
1025496-32-5
Molecular Formula:
C12H10BClO2
Molecular Weight:
232.4706
IUPAC Name:
[4-(3-chlorophenyl)phenyl]boronic acid
InChI:
InChI=1S/C12H10BClO2/c14-12-3-1-2-10(8-12)9-4-6-11(7-5-9)13(15)16/h1-8,15-16H
InChI Key:
MHTJADAVSSOHSH-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)c1ccc(cc1)B(O)O
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.046g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.47g/mol
Monoisotopic Mass:
232.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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