6-chloro-3-(3-phenylprop-2-enoyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-3-(3-phenylprop-2-enoyl)-2H-1-benzopyran-2-one
6-chloro-3-(3-phenylprop-2-enoyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K229-0364 |
| Compound Name: | 6-chloro-3-(3-phenylprop-2-enoyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 310.73 |
| Molecular Formula: | C18 H11 Cl O3 |
| Smiles: | C(=C/c1ccccc1)\C(C1=Cc2cc(ccc2OC1=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2467 |
| logD: | 4.2467 |
| logSw: | -4.6634 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.136 |
| InChI Key: | PQYWVZDQDMUNAT-UHFFFAOYSA-N |