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338401-02-8

338401-02-8 structural image
Product Name: N-(5-IODO-2-PYRIDINYL)-3-(TRIFLUOROMETHYL)BENZENECARBOXAMIDE
Formula: C13H8F3IN2O
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COMPUTED DESCRIPTORS

Molecular Weight 392.11 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 391.96334 g/mol
Monoisotopic Mass 391.96334 g/mol
Topological Polar Surface Area 42 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 351
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