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89863-64-9

89863-64-9 structural image
Product Name: 2,4-Pentanedione, 3-[1-(2-furanyl)-2-[(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)sulfonyl]ethyl]-
Formula: C17H13F13O5S
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COMPUTED DESCRIPTORS

Molecular Weight 576.3 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 18
Rotatable Bond Count 11
Exact Mass 576.0276108 g/mol
Monoisotopic Mass 576.0276108 g/mol
Topological Polar Surface Area 89.8 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 939
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes