3-tert-butyl-4-methyl-8,9,10,11-tetrahydro-7H-1,6-dioxacyclopenta[c]phenanthren-7-one
Chemical Structure Depiction of
3-tert-butyl-4-methyl-8,9,10,11-tetrahydro-7H-1,6-dioxacyclopenta[c]phenanthren-7-one
3-tert-butyl-4-methyl-8,9,10,11-tetrahydro-7H-1,6-dioxacyclopenta[c]phenanthren-7-one
Compound characteristics
| Compound ID: | D129-0108 |
| Compound Name: | 3-tert-butyl-4-methyl-8,9,10,11-tetrahydro-7H-1,6-dioxacyclopenta[c]phenanthren-7-one |
| Molecular Weight: | 310.39 |
| Molecular Formula: | C20 H22 O3 |
| Smiles: | Cc1cc2c(C3CCCCC=3C(=O)O2)c2c1c(co2)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 5.2513 |
| logD: | 5.2513 |
| logSw: | -5.2526 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.8734 |
| InChI Key: | CJRMNBZFJSSABM-UHFFFAOYSA-N |