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352530-23-5

352530-23-5 | (2-([1,1'-Biphenyl]-4-yl)vinyl)boronic acid

CAS No: 352530-23-5 Catalog No: AG003BJY MDL No:MFCD04974059

Product Description

Catalog Number:
AG003BJY
Chemical Name:
(2-([1,1'-Biphenyl]-4-yl)vinyl)boronic acid
CAS Number:
352530-23-5
Molecular Formula:
C14H13BO2
Molecular Weight:
224.0628
MDL Number:
MFCD04974059
IUPAC Name:
[(E)-2-(4-phenylphenyl)ethenyl]boronic acid
InChI:
InChI=1S/C14H13BO2/c16-15(17)11-10-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-11,16-17H/b11-10+
InChI Key:
NTRGFVQIGQYKIL-ZHACJKMWSA-N
SMILES:
OB(/C=C/c1ccc(cc1)c1ccccc1)O

Properties

Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
224.101g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
224.066g/mol
Monoisotopic Mass:
224.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Literature

Title Journal
Discovery of boronic acids as novel and potent inhibitors of fatty acid amide hydrolase. Journal of medicinal chemistry 20081127

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