HuagongsheHuagongshe Chemistry Print Report · For research reference only
11-(2-Bromoethyl)henicosane
11-(2-Bromoethyl)henicosane · 11-(2-Bromoethyl)heneicosane · Heneicosane, 11-(2-bromoethyl)- · IN1058, 11-(2-Bromoethyl)henicosane

Identifiers & Physical Properties
| CAS No. | 2229857-29-6 |
|---|---|
| Molecular formula | C23H47Br |
| Average molar mass | 403.5 g/mol |
| Monoisotopic mass | 402.28611 g/mol |
| SMILES | CCCCCCCCCCC(CCBr)CCCCCCCCCC |
| InChIKey | QTLXHSCMYKVASB-UHFFFAOYSA-N |
| PubChem CID | 155921355 |
Chemical & Physical Properties
| XLogP | 12.4 |
|---|---|
| Topological polar surface area | 0 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 0 |
| Rotatable bonds | 20 |
| Heavy atoms | 24 |
| Formal charge | 0 |
| Complexity | 194 |
| Boiling point | 445.6±13.0 °C(Predicted) |
| Density | 0.956±0.06 g/cm3(Predicted) |