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551930-92-8

551930-92-8 structural image
Product Name: ETHYL 1-(4-CHLOROBENZYL)-2-OXO-6-(TRIFLUOROMETHYL)-1,2-DIHYDRO-3-PYRIDINECARBOXYLATE
Formula: C16H13ClF3NO3
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COMPUTED DESCRIPTORS

Molecular Weight 359.73 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 359.0536055 g/mol
Monoisotopic Mass 359.0536055 g/mol
Topological Polar Surface Area 46.6 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 563
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