methyl [(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Chemical Structure Depiction of
methyl [(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
methyl [(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | 3532-0772 |
| Compound Name: | methyl [(8-hexyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate |
| Molecular Weight: | 358.43 |
| Molecular Formula: | C21 H26 O5 |
| Smiles: | CCCCCCc1cc2C3CCCC=3C(=O)Oc2cc1OCC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.8784 |
| logD: | 4.8784 |
| logSw: | -4.7183 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.611 |
| InChI Key: | BPFIFGANOXUEEU-UHFFFAOYSA-N |