1-(3,3-dimethyl-2-oxobutoxy)-7,8,9,10-tetrahydro-6H-benzo[d]naphtho[1,2-b]pyran-6-one
Chemical Structure Depiction of
1-(3,3-dimethyl-2-oxobutoxy)-7,8,9,10-tetrahydro-6H-benzo[d]naphtho[1,2-b]pyran-6-one
1-(3,3-dimethyl-2-oxobutoxy)-7,8,9,10-tetrahydro-6H-benzo[d]naphtho[1,2-b]pyran-6-one
Compound characteristics
| Compound ID: | Y040-4188 |
| Compound Name: | 1-(3,3-dimethyl-2-oxobutoxy)-7,8,9,10-tetrahydro-6H-benzo[d]naphtho[1,2-b]pyran-6-one |
| Molecular Weight: | 364.44 |
| Molecular Formula: | C23 H24 O4 |
| Smiles: | CC(C)(C)C(COc1cccc2c3c(ccc12)C1CCCCC=1C(=O)O3)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8743 |
| logD: | 5.8743 |
| logSw: | -5.7694 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.326 |
| InChI Key: | KMPXEQOMCSTXSF-UHFFFAOYSA-N |