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478049-74-0

478049-74-0 structural image
Product Name: 6-METHYL-2-PHENOXY-4-(TRIFLUOROMETHYL)NICOTINONITRILE
Formula: C14H9F3N2O
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COMPUTED DESCRIPTORS

Molecular Weight 278.23 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 2
Exact Mass 278.06669740 g/mol
Monoisotopic Mass 278.06669740 g/mol
Topological Polar Surface Area 45.9 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 370
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