Methylisothiocyanate
Representations & DB's id
| ||
| ChEBI: | CHEBI:78337 | |
|---|---|---|
| ChEMBL: | CHEMBL396000 | |
| PubChem: | 11167 | |
| IUPAC: | methylimino(sulfanylidene)methane | |
| Standard InChI: | InChI=1S/C2H3NS/c1-3-2-4/h1H3 | |
| Standard InChI Key: | LGDSHSYDSCRFAB-UHFFFAOYSA-N | |
| SMILES: | CN=C=S | |
Molecular propeties
| ||
| AlogP: | 0.72 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 0 | |
| Molecular Weight: | 73 | |
| Topological polar surface area: | 44.4 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.5 | |
| Number of carbons: | 2 | |