(butane-2,2-diyl)di(4,1-phenylene) bis(4-bromobenzoate)
Chemical Structure Depiction of
(butane-2,2-diyl)di(4,1-phenylene) bis(4-bromobenzoate)
(butane-2,2-diyl)di(4,1-phenylene) bis(4-bromobenzoate)
Compound characteristics
| Compound ID: | 0466-0305 |
| Compound Name: | (butane-2,2-diyl)di(4,1-phenylene) bis(4-bromobenzoate) |
| Molecular Weight: | 608.33 |
| Molecular Formula: | C30 H24 Br2 O4 |
| Smiles: | CCC(C)(c1ccc(cc1)OC(c1ccc(cc1)[Br])=O)c1ccc(cc1)OC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 8.8029 |
| logD: | 8.8029 |
| logSw: | -5.9192 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.722 |
| InChI Key: | YSMYZOWFXLXVDT-UHFFFAOYSA-N |