2-[(3-ethyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid
Chemical Structure Depiction of
2-[(3-ethyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid
2-[(3-ethyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid
Compound characteristics
| Compound ID: | D715-2564 |
| Compound Name: | 2-[(3-ethyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoic acid |
| Molecular Weight: | 290.31 |
| Molecular Formula: | C16 H18 O5 |
| Smiles: | CCC1=C(C)c2ccc(c(C)c2OC1=O)OC(C)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3184 |
| logD: | -0.681 |
| logSw: | -3.3153 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.128 |
| InChI Key: | FDOHCULLURALNG-JTQLQIEISA-N |