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2453-44-3

2453-44-3 | 2-Propen-1-one, 1-[1,1'-biphenyl]-4-yl-3-phenyl-

CAS No: 2453-44-3 Catalog No: AG002OFL MDL No:

Product Description

Catalog Number:
AG002OFL
Chemical Name:
2-Propen-1-one, 1-[1,1'-biphenyl]-4-yl-3-phenyl-
CAS Number:
2453-44-3
Molecular Formula:
C21H16O
Molecular Weight:
284.3511
IUPAC Name:
(E)-3-phenyl-1-(4-phenylphenyl)prop-2-en-1-one
InChI:
InChI=1S/C21H16O/c22-21(16-11-17-7-3-1-4-8-17)20-14-12-19(13-15-20)18-9-5-2-6-10-18/h1-16H/b16-11+
InChI Key:
LTWFSMHHLMTFFU-LFIBNONCSA-N
SMILES:
O=C(c1ccc(cc1)c1ccccc1)C=Cc1ccccc1
NSC Number:
55817

Properties

Complexity:
363  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
284.12g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.358g/mol
Monoisotopic Mass:
284.12g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  

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