5-hydroxy-4-methyl-7-pentyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
5-hydroxy-4-methyl-7-pentyl-2H-1-benzopyran-2-one
5-hydroxy-4-methyl-7-pentyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 0303-0013 |
| Compound Name: | 5-hydroxy-4-methyl-7-pentyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 246.3 |
| Molecular Formula: | C15 H18 O3 |
| Smiles: | CCCCCc1cc(c2C(C)=CC(=O)Oc2c1)O |
| Stereo: | ACHIRAL |
| logP: | 4.3666 |
| logD: | 4.1998 |
| logSw: | -4.0646 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.194 |
| InChI Key: | JNQRCHFZDNUMRU-UHFFFAOYSA-N |