3-(2-oxopropoxy)-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Chemical Structure Depiction of
3-(2-oxopropoxy)-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
3-(2-oxopropoxy)-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Compound characteristics
| Compound ID: | Y040-0848 |
| Compound Name: | 3-(2-oxopropoxy)-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one |
| Molecular Weight: | 286.33 |
| Molecular Formula: | C17 H18 O4 |
| Smiles: | CC(COc1ccc2C3CCCCCC=3C(=O)Oc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9809 |
| logD: | 2.9809 |
| logSw: | -3.2244 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.246 |
| InChI Key: | OHGBRZXQKVPTQC-UHFFFAOYSA-N |