HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-[(Methylsulfanyl)methyl]naphthalen-2-amine
![1-[(Methylsulfanyl)methyl]naphthalen-2-amine molecular structure](/img/chemical/12371897.png)
Identifiers & Physical Properties
| CAS No. | 63017-82-3 |
|---|---|
| Molecular formula | C12H13NS |
| Average molar mass | 203.31 g/mol |
| Monoisotopic mass | 203.07687059 g/mol |
| SMILES | CSCc1c(N)ccc2ccccc12 |
| InChIKey | UVWOYHWPMDGELQ-UHFFFAOYSA-N |
| PubChem CID | 12371897 |
| DTXSID | DTXSID80494887 |
Chemical & Physical Properties
| XLogP | 2.9 |
|---|---|
| Topological polar surface area | 51.3 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 2 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 183 |