4-chloro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-chloro-2H-1-benzopyran-2-one
4-chloro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 0157-0001 |
| Compound Name: | 4-chloro-2H-1-benzopyran-2-one |
| Molecular Weight: | 180.59 |
| Molecular Formula: | C9 H5 Cl O2 |
| Smiles: | C1=C(c2ccccc2OC1=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.0779 |
| logD: | 2.0779 |
| logSw: | -2.9435 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.6457 |
| InChI Key: | RKEYJFRSDLEQIE-UHFFFAOYSA-N |