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Home > Fluorides > 154931-14-3
154931-14-3 | 2H-Pyran-2-one, 5-fluoro-4-hydroxy-6-phenyl-3-(2,4,6-trimethylphenyl)-
CAS No: 154931-14-3 Catalog No: AG001NHC MDL No:
Product Description
Catalog Number:
AG001NHC
Chemical Name:
2H-Pyran-2-one, 5-fluoro-4-hydroxy-6-phenyl-3-(2,4,6-trimethylphenyl)-
CAS Number:
154931-14-3
Molecular Formula:
C20H17FO3
Molecular Weight:
324.3456
IUPAC Name:
5-fluoro-4-hydroxy-6-phenyl-3-(2,4,6-trimethylphenyl)pyran-2-one
InChI:
InChI=1S/C20H17FO3/c1-11-9-12(2)15(13(3)10-11)16-18(22)17(21)19(24-20(16)23)14-7-5-4-6-8-14/h4-10,22H,1-3H3
InChI Key:
PAVGRSMRJBITMF-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)C)c1c(=O)oc(c(c1O)F)c1ccccc1
Properties
Complexity:
559
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.116g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
324.351g/mol
Monoisotopic Mass:
324.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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