3-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl)propanoic acid
Chemical Structure Depiction of
3-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl)propanoic acid
3-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl)propanoic acid
Compound characteristics
| Compound ID: | Y041-9820 |
| Compound Name: | 3-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl)propanoic acid |
| Molecular Weight: | 346.38 |
| Molecular Formula: | C19 H22 O6 |
| Smiles: | CC1=C(CCC(O)=O)C(=O)Oc2c3CCC(C)(C)Oc3cc(c12)OC |
| Stereo: | ACHIRAL |
| logP: | 3.0357 |
| logD: | 0.5394 |
| logSw: | -3.0985 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.191 |
| InChI Key: | QJTJZLXNETXUGL-UHFFFAOYSA-N |