3-[3-(4-bromophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[3-(4-bromophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
3-[3-(4-bromophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K229-0019 |
| Compound Name: | 3-[3-(4-bromophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 355.19 |
| Molecular Formula: | C18 H11 Br O3 |
| Smiles: | C(=C/c1ccc(cc1)[Br])\C(C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4644 |
| logD: | 4.4644 |
| logSw: | -4.8093 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.136 |
| InChI Key: | PAOWCYOCGZAQIT-UHFFFAOYSA-N |