4-{[(2-hexyl-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-hexyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}-5-methylfuran-2-carboxylic acid
4-{[(2-hexyl-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: | 4986-0933 |
| Compound Name: | 4-{[(2-hexyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}-5-methylfuran-2-carboxylic acid |
| Molecular Weight: | 438.52 |
| Molecular Formula: | C26 H30 O6 |
| Smiles: | CCCCCCc1cc2C3CCCCC=3C(=O)Oc2cc1OCc1cc(C(O)=O)oc1C |
| Stereo: | ACHIRAL |
| logP: | 6.5214 |
| logD: | 3.2311 |
| logSw: | -5.4084 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.129 |
| InChI Key: | MIWAUWXYMFAREM-UHFFFAOYSA-N |