6-chloro-7-[(2,5-dimethylphenyl)methoxy]-4-ethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-7-[(2,5-dimethylphenyl)methoxy]-4-ethyl-2H-1-benzopyran-2-one
6-chloro-7-[(2,5-dimethylphenyl)methoxy]-4-ethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-2112 |
| Compound Name: | 6-chloro-7-[(2,5-dimethylphenyl)methoxy]-4-ethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 342.82 |
| Molecular Formula: | C20 H19 Cl O3 |
| Smiles: | CCC1=CC(=O)Oc2cc(c(cc12)[Cl])OCc1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 5.9148 |
| logD: | 5.9148 |
| logSw: | -6.07 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.9599 |
| InChI Key: | OMPNAYNYJVYBLQ-UHFFFAOYSA-N |