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338966-59-9

338966-59-9 structural image
Product Name: 2-[5-(4-FLUOROBENZOYL)-2-THIENYL]ACETONITRILE
Formula: C13H8FNOS
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COMPUTED DESCRIPTORS

Molecular Weight 245.27 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 245.03106321 g/mol
Monoisotopic Mass 245.03106321 g/mol
Topological Polar Surface Area 69.1 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 330
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