4-{[(2-ethyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}-5-methylfuran-2-carboxylic acid
Chemical Structure Depiction of
4-{[(2-ethyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}-5-methylfuran-2-carboxylic acid
4-{[(2-ethyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}-5-methylfuran-2-carboxylic acid
Compound characteristics
| Compound ID: | 4182-0784 |
| Compound Name: | 4-{[(2-ethyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}-5-methylfuran-2-carboxylic acid |
| Molecular Weight: | 382.41 |
| Molecular Formula: | C22 H22 O6 |
| Smiles: | CCc1cc2C3CCCCC=3C(=O)Oc2cc1OCc1cc(C(O)=O)oc1C |
| Stereo: | ACHIRAL |
| logP: | 4.4323 |
| logD: | 1.142 |
| logSw: | -4.2225 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.129 |
| InChI Key: | XEJWOLHPBMESOG-UHFFFAOYSA-N |