Pyridin-4-yl-acetonitrile
- Product NamePyridin-4-yl-acetonitrile
- CAS13121-99-8
- CBNumberCB3211175
- MFC7H6N2
- MW118.14
- MDL NumberMFCD03412601
- MOL File13121-99-8.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 52-53 °C(Solv: ligroine (8032-32-4)) |
| Boiling point | 89-91 °C(Press: 0.1 Torr) |
| Density | 1.085±0.06 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2-8°C |
| form | Solid |
| pka | 4.49±0.10(Predicted) |
| Appearance | Orange to red <52°C Solid,>53°C Liquid |
| Water Solubility | Slightly soluble in water. |
| InChI | InChI=1S/C7H6N2/c8-4-1-7-2-5-9-6-3-7/h2-3,5-6H,1H2 |
| InChIKey | BMVSAKPRNWZCPG-UHFFFAOYSA-N |
| SMILES | C1=NC=CC(CC#N)=C1 |
Safety
| Symbol(GHS) |
|
|||||||||
| Signal word | Warning | |||||||||
| Hazard statements | H302-H312-H315-H319-H332-H335 | |||||||||
| Precautionary statements | P261-P280-P304+P340-P305+P351+P338-P405-P501a | |||||||||
| HazardClass | 6.1 | |||||||||
| NFPA 704: |
|