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80791-12-4

80791-12-4 structural image
Product Name: METHYL 4-(PERFLUOROOCTYL)BENZOATE
Formula: C16H7F17O2
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COMPUTED DESCRIPTORS

Molecular Weight 554.20 g/mol
XLogP3 7.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 19
Rotatable Bond Count 9
Exact Mass 554.0174582 g/mol
Monoisotopic Mass 554.0174582 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 777
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes