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338960-15-9

338960-15-9 structural image
Product Name: ETHYL 4-(4-NITROPHENYL)-6-OXO-2-(TRIFLUOROMETHYL)-1,4,5,6-TETRAHYDRO-3-PYRIDINECARBOXYLATE
Formula: C15H13F3N2O5
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COMPUTED DESCRIPTORS

Molecular Weight 358.27 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 4
Exact Mass 358.07765601 g/mol
Monoisotopic Mass 358.07765601 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 589
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