methyl 2-[(2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoate
Chemical Structure Depiction of
methyl 2-[(2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoate
methyl 2-[(2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoate
Compound characteristics
| Compound ID: | 3532-1023 |
| Compound Name: | methyl 2-[(2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoate |
| Molecular Weight: | 336.77 |
| Molecular Formula: | C17 H17 Cl O5 |
| Smiles: | CC(C(=O)OC)Oc1cc2c(cc1[Cl])C1CCCCC=1C(=O)O2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2489 |
| logD: | 4.2489 |
| logSw: | -4.5665 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.13 |
| InChI Key: | QPYGAUAXLDRDKP-VIFPVBQESA-N |