371967-27-0
Product Name:
2-OXO-4-TRIFLUOROMETHYL-2,5,6,7-TETRAHYDRO-1H-[1]PYRIDINDINE-3-CARBONITRILE
Formula:
C10H7F3N2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 228.17 g/mol |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 0 |
| Exact Mass | 228.05104734 g/mol |
| Monoisotopic Mass | 228.05104734 g/mol |
| Topological Polar Surface Area | 52.9 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 476 |
| 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 |