HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-(1-Adamantyl)-5-propan-2-yltetrazole
Identifiers & Physical Properties
| CAS No. | 24886-64-4 |
|---|---|
| Molecular formula | C14H22N4 |
| Average molar mass | 246.35 g/mol |
| Monoisotopic mass | 246.18444672 g/mol |
| SMILES | CC(C)c1nnnn1C12CC3CC(CC(C3)C1)C2 |
| InChIKey | JOLLRSUOWRERSF-UHFFFAOYSA-N |
| PubChem CID | 284635 |
| DTXSID | DTXSID40301043 |
Chemical & Physical Properties
| XLogP | 3.3 |
|---|---|
| Topological polar surface area | 43.6 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 299 |