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20458-67-7 | Ethanone, 1-[1,1'-biphenyl]-4-yl-2-bromo-2-phenyl-
CAS No: 20458-67-7 Catalog No: AG0029KS MDL No:
Product Description
Catalog Number:
AG0029KS
Chemical Name:
Ethanone, 1-[1,1'-biphenyl]-4-yl-2-bromo-2-phenyl-
CAS Number:
20458-67-7
Molecular Formula:
C20H15BrO
Molecular Weight:
351.2365
IUPAC Name:
2-bromo-2-phenyl-1-(4-phenylphenyl)ethanone
InChI:
InChI=1S/C20H15BrO/c21-19(17-9-5-2-6-10-17)20(22)18-13-11-16(12-14-18)15-7-3-1-4-8-15/h1-14,19H
InChI Key:
KLNGHXJBADJMIJ-UHFFFAOYSA-N
SMILES:
BrC(C(=O)c1ccc(cc1)c1ccccc1)c1ccccc1
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.031g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
351.243g/mol
Monoisotopic Mass:
350.031g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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