2-[(2-hexyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoic acid
Chemical Structure Depiction of
2-[(2-hexyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoic acid
2-[(2-hexyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoic acid
Compound characteristics
| Compound ID: | 4182-0946 |
| Compound Name: | 2-[(2-hexyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]propanoic acid |
| Molecular Weight: | 372.46 |
| Molecular Formula: | C22 H28 O5 |
| Smiles: | CCCCCCc1cc2C3CCCCC=3C(=O)Oc2cc1OC(C)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1892 |
| logD: | 2.1899 |
| logSw: | -5.1214 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.364 |
| InChI Key: | JRQQLKKJCGKFDO-AWEZNQCLSA-N |