873055-00-6
Product Name:
ETHYL 4,5-DIOXO-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3-CARBOXYLATE
Formula:
C12H13NO4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 235.24 g/mol |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 235.08445790 g/mol |
| Monoisotopic Mass | 235.08445790 g/mol |
| Topological Polar Surface Area | 72.5 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 459 |
| 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 |