672925-22-3
Product Name:
1-(4-CHLOROBENZYL)-2-OXO-6-(TRIFLUOROMETHYL)-1,2-DIHYDRO-3-PYRIDINECARBOXYLIC ACID
Formula:
C14H9ClF3NO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 331.67 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 331.0223053 g/mol |
| Monoisotopic Mass | 331.0223053 g/mol |
| Topological Polar Surface Area | 57.6 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 534 |
| 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 |