
39546-32-2
| Name | Hexahydroisonicotinamide |
| CAS | 39546-32-2 |
| EINECS(EC#) | 254-501-6 |
| Molecular Formula | C6H12N2O |
| MDL Number | MFCD00038012 |
| Molecular Weight | 128.17 |
| MOL File | 39546-32-2.mol |
Chemical Properties
| Appearance | WHITE TO LIGHT YELLOW CRYSTALLINE POWDER |
| Melting point | 145-148 °C(lit.) |
| Boiling point | 237.61°C (rough estimate) |
| density | 1.0754 (rough estimate) |
| refractive index | 1.4880 (estimate) |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| solubility | DMSO (Sparingly), Methanol (Slightly) |
| form | Crystalline Powder |
| pka | 16.48±0.20(Predicted) |
| color | White to light yellow |
| Water Solubility | Soluble in water. |
| Sensitive | Hygroscopic |
| BRN | 112554 |
| Stability: | Hygroscopic |
| InChI | 1S/C6H12N2O/c7-6(9)5-1-3-8-4-2-5/h5,8H,1-4H2,(H2,7,9) |
| InChIKey | DPBWFNDFMCCGGJ-UHFFFAOYSA-N |
| SMILES | NC(=O)C1CCNCC1 |
| LogP | -0.88 |
| CAS DataBase Reference | 39546-32-2(CAS DataBase Reference) |
Safety Data
| Symbol(GHS) | ![]() GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| Hazard Note | Irritant |
| TSCA | Yes |
| HS Code | 29339900 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
