3-(4-tert-butylphenyl)-6-chloro-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(4-tert-butylphenyl)-6-chloro-4H-1-benzopyran-4-one
3-(4-tert-butylphenyl)-6-chloro-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | V029-5901 |
| Compound Name: | 3-(4-tert-butylphenyl)-6-chloro-4H-1-benzopyran-4-one |
| Molecular Weight: | 312.79 |
| Molecular Formula: | C19 H17 Cl O2 |
| Smiles: | CC(C)(C)c1ccc(cc1)C1=COc2ccc(cc2C1=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.5179 |
| logD: | 5.5179 |
| logSw: | -5.904 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.86 |
| InChI Key: | RUJXAVZDKALSDC-UHFFFAOYSA-N |