tert-butyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Chemical Structure Depiction of
tert-butyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
tert-butyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y040-1228 |
| Compound Name: | tert-butyl [(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate |
| Molecular Weight: | 316.35 |
| Molecular Formula: | C18 H20 O5 |
| Smiles: | CC(C)(C)OC(COc1ccc2C3CCCC=3C(=O)Oc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1063 |
| logD: | 3.1063 |
| logSw: | -3.2575 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.214 |
| InChI Key: | VHGOMPRZBBRCDC-UHFFFAOYSA-N |