methyl 2-[(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate
Chemical Structure Depiction of
methyl 2-[(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate
methyl 2-[(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate
Compound characteristics
| Compound ID: | 4182-0909 |
| Compound Name: | methyl 2-[(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate |
| Molecular Weight: | 372.46 |
| Molecular Formula: | C22 H28 O5 |
| Smiles: | CCCCCCc1cc2C3CCCC=3C(=O)Oc2cc1OC(C)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6185 |
| logD: | 5.6185 |
| logSw: | -5.2525 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.496 |
| InChI Key: | WDCRBXKCSKPKOD-AWEZNQCLSA-N |