HuagongsheHuagongshe Chemistry Print Report · For research reference only
(9-Methyl-6-thiocyanatocarbazol-3-yl) thiocyanate
Identifiers & Physical Properties
| CAS No. | 64434-93-1 |
|---|---|
| Molecular formula | C15H9N3S2 |
| Average molar mass | 295.4 g/mol |
| Monoisotopic mass | 295.02378965 g/mol |
| SMILES | Cn1c2ccc(SC#N)cc2c2cc(SC#N)ccc21 |
| InChIKey | BMNGEFUPWKBUNN-UHFFFAOYSA-N |
| PubChem CID | 12378464 |
| DTXSID | DTXSID50495280 |
Chemical & Physical Properties
| XLogP | 4.5 |
|---|---|
| Topological polar surface area | 103 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 2 |
| Heavy atoms | 20 |
| Formal charge | 0 |
| Complexity | 420 |