methyl 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate
Chemical Structure Depiction of
methyl 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate
methyl 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate
Compound characteristics
| Compound ID: | 3532-0734 |
| Compound Name: | methyl 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate |
| Molecular Weight: | 322.74 |
| Molecular Formula: | C16 H15 Cl O5 |
| Smiles: | CC(C(=O)OC)Oc1cc2c(cc1[Cl])C1CCCC=1C(=O)O2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4516 |
| logD: | 3.4516 |
| logSw: | -3.6916 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.496 |
| InChI Key: | GJNSAGCMQLIRMP-QMMMGPOBSA-N |