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113478-79-8 | 1-Propanone, 2-bromo-3-(4-chlorophenyl)-1-phenyl-
CAS No: 113478-79-8 Catalog No: AG0008QK MDL No:
Product Description
Catalog Number:
AG0008QK
Chemical Name:
1-Propanone, 2-bromo-3-(4-chlorophenyl)-1-phenyl-
CAS Number:
113478-79-8
Molecular Formula:
C15H12BrClO
Molecular Weight:
323.6122
IUPAC Name:
2-bromo-3-(4-chlorophenyl)-1-phenylpropan-1-one
InChI:
InChI=1S/C15H12BrClO/c16-14(10-11-6-8-13(17)9-7-11)15(18)12-4-2-1-3-5-12/h1-9,14H,10H2
InChI Key:
XZPFUVGWBBBMCB-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)CC(C(=O)c1ccccc1)Br
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.976g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.614g/mol
Monoisotopic Mass:
321.976g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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