6-chloro-4-ethyl-7-[(2-methoxy-5-nitrophenyl)methoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-4-ethyl-7-[(2-methoxy-5-nitrophenyl)methoxy]-2H-1-benzopyran-2-one
6-chloro-4-ethyl-7-[(2-methoxy-5-nitrophenyl)methoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-7788 |
| Compound Name: | 6-chloro-4-ethyl-7-[(2-methoxy-5-nitrophenyl)methoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 389.79 |
| Molecular Formula: | C19 H16 Cl N O6 |
| Smiles: | CCC1=CC(=O)Oc2cc(c(cc12)[Cl])OCc1cc(ccc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6147 |
| logD: | 4.6147 |
| logSw: | -4.9162 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.972 |
| InChI Key: | XJKDJOPDRBAJIK-UHFFFAOYSA-N |