HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,1-Dimethyl-4-nitro-butylamine trifluoroacetate
Identifiers & Physical Properties
| Molecular formula | C8H15F3N2O4 |
|---|---|
| Average molar mass | 260.21 g/mol |
| Monoisotopic mass | 260.09839145 g/mol |
| SMILES | CC(C)(N)CCC[N+](=O)[O-].O=C(O)C(F)(F)F |
| InChIKey | MEFHKFKJYPCONY-UHFFFAOYSA-N |
| PubChem CID | 21931663 |
Chemical & Physical Properties
| Topological polar surface area | 109 |
|---|---|
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 8 |
| Rotatable bonds | 3 |
| Heavy atoms | 17 |
| Formal charge | 0 |
| Complexity | 201 |