HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-Chloromethyl-4-(3-methoxypropoxy)-3,5-dimethylpyridine
Identifiers & Physical Properties
| Molecular formula | C12H18ClNO2 |
|---|---|
| Average molar mass | 243.73 g/mol |
| Monoisotopic mass | 243.1026065 g/mol |
| SMILES | COCCCOc1c(C)cnc(CCl)c1C |
| InChIKey | KTTCFXPZAAPREE-UHFFFAOYSA-N |
| PubChem CID | 15166323 |
Chemical & Physical Properties
| XLogP | 2.2 |
|---|---|
| Topological polar surface area | 31.4 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 6 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 192 |