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338397-59-4

338397-59-4 structural image
Product Name: 2-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-2-(4-METHOXYPHENYL)PENTANEDINITRILE
Formula: C18H13ClF3N3O
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COMPUTED DESCRIPTORS

Molecular Weight 379.8 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 379.0699242 g/mol
Monoisotopic Mass 379.0699242 g/mol
Topological Polar Surface Area 69.7 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 573
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