2-[(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoic acid
Chemical Structure Depiction of
2-[(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoic acid
2-[(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoic acid
Compound characteristics
| Compound ID: | 3532-0768 |
| Compound Name: | 2-[(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoic acid |
| Molecular Weight: | 358.43 |
| Molecular Formula: | C21 H26 O5 |
| Smiles: | CCCCCCc1cc2C3CCCC=3C(=O)Oc2cc1OC(C)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.392 |
| logD: | 1.3926 |
| logSw: | -5.0736 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.73 |
| InChI Key: | CBQDOUMZGJALAW-ZDUSSCGKSA-N |