Thionicotinamide
- Product NameThionicotinamide
- CAS4621-66-3
- MFC6H6N2S
- MW138.19
- EINECS225-036-6
- MOL File4621-66-3.mol
Chemical Properties
| Melting point | 185-190 °C |
| Boiling point | 278.9±32.0 °C(Predicted) |
| Density | 1.235 (estimate) |
| refractive index | 1.5300 (estimate) |
| Flash point | 160 °C |
| storage temp. | Inert atmosphere,Room Temperature |
| pka | 12.01±0.29(Predicted) |
| form | Powder |
| color | Yellow to yellow-green |
| BRN | 109593 |
| InChI | InChI=1S/C6H6N2S/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9) |
| InChIKey | XQWBMZWDJAZPPX-UHFFFAOYSA-N |
| SMILES | C1=NC=CC=C1C(N)=S |
| LogP | 0.670 |
| CAS DataBase Reference | 4621-66-3(CAS DataBase Reference) |
| EPA Substance Registry System | 3-Pyridinecarbothioamide (4621-66-3) |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 22-36/37/38 |
| Safety Statements | 24/25-36-26 |
| RTECS | QS4488000 |
| TSCA | Yes |
| HazardClass | IRRITANT |
| HS Code | 29333990 |
