9,10-dimethyl-1,2,3,4-tetrahydro-5H-6,8-dioxacyclopenta[b]phenanthren-5-one
Chemical Structure Depiction of
9,10-dimethyl-1,2,3,4-tetrahydro-5H-6,8-dioxacyclopenta[b]phenanthren-5-one
9,10-dimethyl-1,2,3,4-tetrahydro-5H-6,8-dioxacyclopenta[b]phenanthren-5-one
Compound characteristics
| Compound ID: | D143-0445 |
| Compound Name: | 9,10-dimethyl-1,2,3,4-tetrahydro-5H-6,8-dioxacyclopenta[b]phenanthren-5-one |
| Molecular Weight: | 268.31 |
| Molecular Formula: | C17 H16 O3 |
| Smiles: | Cc1c2cc3C4CCCCC=4C(=O)Oc3cc2oc1C |
| Stereo: | ACHIRAL |
| logP: | 4.3013 |
| logD: | 4.3013 |
| logSw: | -4.3402 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.028 |
| InChI Key: | XHLNYQWMGGXIOS-UHFFFAOYSA-N |