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28718-07-2 | 2-Propen-1-one, 1-(2,3,4,5,6-pentafluorophenyl)-3-phenyl-
CAS No: 28718-07-2 Catalog No: AG002W8V MDL No:
Product Description
Catalog Number:
AG002W8V
Chemical Name:
2-Propen-1-one, 1-(2,3,4,5,6-pentafluorophenyl)-3-phenyl-
CAS Number:
28718-07-2
Molecular Formula:
C15H7F5O
Molecular Weight:
298.2075
IUPAC Name:
1-(2,3,4,5,6-pentafluorophenyl)-3-phenylprop-2-en-1-one
InChI:
InChI=1S/C15H7F5O/c16-11-10(12(17)14(19)15(20)13(11)18)9(21)7-6-8-4-2-1-3-5-8/h1-7H
InChI Key:
LBHOSKBIBWDCFT-UHFFFAOYSA-N
SMILES:
O=C(c1c(F)c(F)c(c(c1F)F)F)C=Cc1ccccc1
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.042g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.212g/mol
Monoisotopic Mass:
298.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.2
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