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1005047-31-3

1005047-31-3 structural image
Product Name: 6,7-DIMETHYL-8-(2-[3-(TRIFLUOROMETHYL)PHENOXY]PHENYL)-7,8-DIHYDRO-6H-[1,3]DIOXOLO[4,5-G]CHROMEN-6-OL
Formula: C25H21F3O5
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COMPUTED DESCRIPTORS

Molecular Weight 458.4 g/mol
XLogP3 6.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 3
Exact Mass 458.13410825 g/mol
Monoisotopic Mass 458.13410825 g/mol
Topological Polar Surface Area 57.2 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 689
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes