HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,2,2,4-Tetramethyl-1,2-dihydroquinoline
1,2,2,4-tetramethylquinoline · 1,2-Dihydro-1,2,2,4-tetramethylquinoline · Quinoline, 1,2-dihydro-1,2,2,4-tetramethyl-
Identifiers & Physical Properties
| CAS No. | 46255-82-7 |
|---|---|
| Molecular formula | C13H17N |
| Average molar mass | 187.28 g/mol |
| Monoisotopic mass | 187.13609955 g/mol |
| SMILES | CC1=CC(C)(C)N(C)c2ccccc21 |
| InChIKey | BWVDOMYGBPMGKV-UHFFFAOYSA-N |
| PubChem CID | 14045708 |
| DTXSID | DTXSID10554963 |
Chemical & Physical Properties
| XLogP | 2.9 |
|---|---|
| Topological polar surface area | 3.2 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 0 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 252 |
| Boiling point | 131-132 °C(Press: 3 Torr) |
| Density | 0.950±0.06 g/cm3(Predicted) |
| pKa (acidity coefficient) | 5.05±0.60(Predicted) |