551930-92-8
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 |