tert-butyl [(6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Chemical Structure Depiction of
tert-butyl [(6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
tert-butyl [(6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y040-2064 |
| Compound Name: | tert-butyl [(6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]acetate |
| Molecular Weight: | 330.38 |
| Molecular Formula: | C19 H22 O5 |
| Smiles: | Cc1c(ccc2C3CCCC=3C(=O)Oc12)OCC(=O)OC(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 3.6386 |
| logD: | 3.6386 |
| logSw: | -3.8017 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.985 |
| InChI Key: | QRXHRSIAAPNXOI-UHFFFAOYSA-N |