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337367-02-9

337367-02-9 structural image
Product Name: 4-CYANO-3,5-DIFLUOROPHENYL 4-BUTYL-BENZOATE
Formula: C18H15F2NO2
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COMPUTED DESCRIPTORS

Molecular Weight 315.3 g/mol
XLogP3 5.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 315.10708505 g/mol
Monoisotopic Mass 315.10708505 g/mol
Topological Polar Surface Area 50.1 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 428
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