4-methyl-2-oxo-2H-1-benzopyran-7-yl chloroacetate
Chemical Structure Depiction of
4-methyl-2-oxo-2H-1-benzopyran-7-yl chloroacetate
4-methyl-2-oxo-2H-1-benzopyran-7-yl chloroacetate
Compound characteristics
| Compound ID: | R052-1895 |
| Compound Name: | 4-methyl-2-oxo-2H-1-benzopyran-7-yl chloroacetate |
| Molecular Weight: | 252.65 |
| Molecular Formula: | C12 H9 Cl O4 |
| Smiles: | CC1=CC(=O)Oc2cc(ccc12)OC(C[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.876 |
| logD: | 1.876 |
| logSw: | -2.6104 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.7 |
| InChI Key: | DNVAMQZOGHDQNS-UHFFFAOYSA-N |