1,3-Phenylenediacetonitrile
- Product Name1,3-Phenylenediacetonitrile
- CAS626-22-2
- MFC10H8N2
- MW156.18
- EINECS210-936-3
- MOL File626-22-2.mol
Chemical Properties
| Melting point | 32-35 °C (lit.) |
| Boiling point | 170 °C/25 mmHg (lit.) |
| Density | 1.1566 (rough estimate) |
| refractive index | 1.6057 (estimate) |
| Flash point | >230 °F |
| storage temp. | Store at room temperature |
| form | powder to lump to clear liquid |
| color | White or Colorless to Light yellow |
| Water Solubility | insoluble |
| BRN | 3240670 |
| InChI | 1S/C10H8N2/c11-6-4-9-2-1-3-10(8-9)5-7-12/h1-3,8H,4-5H2 |
| InChIKey | GRPFZJNUYXIVSL-UHFFFAOYSA-N |
| SMILES | N#CCc1cccc(CC#N)c1 |
| CAS DataBase Reference | 626-22-2(CAS DataBase Reference) |
| NIST Chemistry Reference | 1,3-Benzenediacetonitrile(626-22-2) |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 20/21/22-36/37/38 |
| Safety Statements | 26-37/39-24/25-36 |
| RIDADR | 3439 |
| WGK Germany | 3 |
| RTECS | AM1780000 |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29269095 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
