339106-48-8
Product Name:
ETHYL 3-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-4-(DIMETHYLAMINO)-2-OXO-3-BUTENOATE
Formula:
C14H14ClF3N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 350.72 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 350.0645045 g/mol |
| Monoisotopic Mass | 350.0645045 g/mol |
| Topological Polar Surface Area | 59.5 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 480 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |