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Home > Boronic Acids > 406482-73-3
406482-73-3 | (4'-Cyano-[1,1'-biphenyl]-4-yl)boronic acid
CAS No: 406482-73-3 Catalog No: AG00769L MDL No:MFCD08275641
Product Description
Catalog Number:
AG00769L
Chemical Name:
(4'-Cyano-[1,1'-biphenyl]-4-yl)boronic acid
CAS Number:
406482-73-3
Molecular Formula:
C13H10BNO2
Molecular Weight:
223.0350
MDL Number:
MFCD08275641
IUPAC Name:
[4-(4-cyanophenyl)phenyl]boronic acid
InChI:
InChI=1S/C13H10BNO2/c15-9-10-1-3-11(4-2-10)12-5-7-13(8-6-12)14(16)17/h1-8,16-17H
InChI Key:
JYKQRYHFHIAGJD-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)c1ccc(cc1)B(O)O
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.08g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
223.038g/mol
Monoisotopic Mass:
223.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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