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Home > Boronic Acids > 1029438-14-9

1029438-14-9

1029438-14-9 | (4'-Acetyl-[1,1'-biphenyl]-4-yl);boronic acid

CAS No: 1029438-14-9 Catalog No: AG007IJC MDL No:MFCD16295057

Product Description

Catalog Number:
AG007IJC
Chemical Name:
(4'-Acetyl-[1,1'-biphenyl]-4-yl);boronic acid
CAS Number:
1029438-14-9
Molecular Formula:
C14H13BO3
Molecular Weight:
240.0622
MDL Number:
MFCD16295057
IUPAC Name:
[4-(4-acetylphenyl)phenyl]boronic acid
InChI:
InChI=1S/C14H13BO3/c1-10(16)11-2-4-12(5-3-11)13-6-8-14(9-7-13)15(17)18/h2-9,17-18H,1H3
InChI Key:
KLFRIBXIZZFOBU-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)c1ccc(cc1)C(=O)C)O

Properties

Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.096g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
240.065g/mol
Monoisotopic Mass:
240.096g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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