4-[6-(acetyloxy)-1,2,3,9a-tetrahydro-3aH-spiro[benzo[b]cyclopenta[e]pyran-9,1'-cyclopentan]-3a-yl]-1,3-phenylene diacetate
Chemical Structure Depiction of
4-[6-(acetyloxy)-1,2,3,9a-tetrahydro-3aH-spiro[benzo[b]cyclopenta[e]pyran-9,1'-cyclopentan]-3a-yl]-1,3-phenylene diacetate
4-[6-(acetyloxy)-1,2,3,9a-tetrahydro-3aH-spiro[benzo[b]cyclopenta[e]pyran-9,1'-cyclopentan]-3a-yl]-1,3-phenylene diacetate
Compound characteristics
| Compound ID: | 8015-1586 |
| Compound Name: | 4-[6-(acetyloxy)-1,2,3,9a-tetrahydro-3aH-spiro[benzo[b]cyclopenta[e]pyran-9,1'-cyclopentan]-3a-yl]-1,3-phenylene diacetate |
| Molecular Weight: | 478.54 |
| Molecular Formula: | C28 H30 O7 |
| Smiles: | CC(=O)Oc1ccc(c(c1)OC(C)=O)C12CCCC1C1(CCCC1)c1ccc(cc1O2)OC(C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8991 |
| logD: | 3.8991 |
| logSw: | -4.0276 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.522 |
| InChI Key: | FFWRICQTHUAKHI-UHFFFAOYSA-N |