[(4-ethyl-8,8-dimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetic acid
Chemical Structure Depiction of
[(4-ethyl-8,8-dimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetic acid
[(4-ethyl-8,8-dimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetic acid
Compound characteristics
| Compound ID: | Y042-9905 |
| Compound Name: | [(4-ethyl-8,8-dimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-5-yl)oxy]acetic acid |
| Molecular Weight: | 332.35 |
| Molecular Formula: | C18 H20 O6 |
| Smiles: | CCC1=CC(=O)Oc2c3CCC(C)(C)Oc3cc(c12)OCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1932 |
| logD: | -1.0438 |
| logSw: | -3.3668 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.632 |
| InChI Key: | FMGPWHKZWDGFSN-UHFFFAOYSA-N |