7-(3,3-dimethyl-2-oxobutoxy)-3-ethyl-4,8-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-(3,3-dimethyl-2-oxobutoxy)-3-ethyl-4,8-dimethyl-2H-1-benzopyran-2-one
7-(3,3-dimethyl-2-oxobutoxy)-3-ethyl-4,8-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0620 |
| Compound Name: | 7-(3,3-dimethyl-2-oxobutoxy)-3-ethyl-4,8-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 316.4 |
| Molecular Formula: | C19 H24 O4 |
| Smiles: | CCC1=C(C)c2ccc(c(C)c2OC1=O)OCC(C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4754 |
| logD: | 4.4754 |
| logSw: | -4.5455 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.677 |
| InChI Key: | QOXTUXDJOTWMGW-UHFFFAOYSA-N |