4-methyl-2-oxo-2H-1-benzopyran-7-yl 3-chlorobenzoate
Chemical Structure Depiction of
4-methyl-2-oxo-2H-1-benzopyran-7-yl 3-chlorobenzoate
4-methyl-2-oxo-2H-1-benzopyran-7-yl 3-chlorobenzoate
Compound characteristics
| Compound ID: | 1889-1879 |
| Compound Name: | 4-methyl-2-oxo-2H-1-benzopyran-7-yl 3-chlorobenzoate |
| Molecular Weight: | 314.72 |
| Molecular Formula: | C17 H11 Cl O4 |
| Smiles: | CC1=CC(=O)Oc2cc(ccc12)OC(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6108 |
| logD: | 3.6108 |
| logSw: | -3.9395 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.023 |
| InChI Key: | ZXADCOLCKVCBPU-UHFFFAOYSA-N |