HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-fluoro-3-(2-methyl-2-nitropropyl)-1H-indole
Identifiers & Physical Properties
| Molecular formula | C12H13FN2O2 |
|---|---|
| Average molar mass | 236.24 g/mol |
| Monoisotopic mass | 236.09610582 g/mol |
| SMILES | CC(C)(Cc1c[nH]c2cccc(F)c12)[N+](=O)[O-] |
| InChIKey | XAGVNLJIESZUJZ-UHFFFAOYSA-N |
| PubChem CID | 22014813 |
Chemical & Physical Properties
| XLogP | 2.9 |
|---|---|
| Topological polar surface area | 61.6 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 17 |
| Formal charge | 0 |
| Complexity | 303 |