HuagongsheHuagongshe Chemistry Print Report · For research reference only
trans-(1R,3R)-3-[(Z)-2-chloro-2-(4-chlorophenyl)ethenyl]-2,2-dimethylcyclopropane-1-carboxylic acid
3-[2-chloro-2-(4-chlorophenyl)ethenyl]-2 · 3-[2-chloro-2-(4-chlorophenyl)ethenyl]-2,2-dimethyl cyclopropane carboxylic acid · Cyclopropanecarboxylic acid, 3-[2-chloro-2-(4-chlorophenyl)ethenyl]-2,2-dimethyl-, [1α,3α(Z)]- (9CI)
![trans-(1R,3R)-3-[(Z)-2-chloro-2-(4-chlorophenyl)ethenyl]-2,2-dimethylcyclopropane-1-carboxylic acid molecular structure](/img/chemical/178938545.png)
Identifiers & Physical Properties
| CAS No. | 73610-74-9 |
|---|---|
| Molecular formula | C14H14Cl2O2 |
| Average molar mass | 285.2 g/mol |
| SMILES | CC1(C)[C@H](C(=O)O)[C@@H]1/C=C(\Cl)c1ccc(Cl)cc1 |
| InChIKey | OLKWYZYVQYPFIM-VVOBXSEESA-N |
Chemical & Physical Properties
| XLogP | 4.2 |
|---|---|
| Topological polar surface area | 37.3 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 3 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 368 |
| Boiling point | 424.2±40.0 °C(Predicted) |
| Density | 1.366±0.06 g/cm3(Predicted) |
| pKa (acidity coefficient) | 4.25±0.42(Predicted) |