[(4-butyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetic acid
Chemical Structure Depiction of
[(4-butyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetic acid
[(4-butyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetic acid
Compound characteristics
| Compound ID: | D715-2586 |
| Compound Name: | [(4-butyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetic acid |
| Molecular Weight: | 290.31 |
| Molecular Formula: | C16 H18 O5 |
| Smiles: | CCCCC1=CC(=O)Oc2cc(C)cc(c12)OCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4648 |
| logD: | -0.7721 |
| logSw: | -3.6548 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.615 |
| InChI Key: | RDQWGNDMRXGESG-UHFFFAOYSA-N |