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Home > Boronic Acids > 1214723-26-8
1214723-26-8 | Boronic acid, B-[3-(1-phenyl-1H-benzimidazol-2-yl)phenyl]-
CAS No: 1214723-26-8 Catalog No: AG00150O MDL No:
Product Description
Catalog Number:
AG00150O
Chemical Name:
Boronic acid, B-[3-(1-phenyl-1H-benzimidazol-2-yl)phenyl]-
CAS Number:
1214723-26-8
Molecular Formula:
C19H15BN2O2
Molecular Weight:
314.1456
IUPAC Name:
[3-(1-phenylbenzimidazol-2-yl)phenyl]boronic acid
InChI:
InChI=1S/C19H15BN2O2/c23-20(24)15-8-6-7-14(13-15)19-21-17-11-4-5-12-18(17)22(19)16-9-2-1-3-10-16/h1-13,23-24H
InChI Key:
YALVJUMJQAACQL-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)c1nc2c(n1c1ccccc1)cccc2)O
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.123g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
314.151g/mol
Monoisotopic Mass:
314.123g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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