626-22-2
| Name | 1,3-Phenylenediacetonitrile |
| CAS | 626-22-2 |
| EINECS(EC#) | 210-936-3 |
| Molecular Formula | C10H8N2 |
| MDL Number | MFCD00001915 |
| Molecular Weight | 156.18 |
| MOL File | 626-22-2.mol |
Chemical Properties
| Appearance | WHITE ADHERING CRYSTALS |
| Melting point | 32-35 °C (lit.) |
| Boiling point | 170 °C/25 mmHg (lit.) |
| density | 1.1566 (rough estimate) |
| refractive index | 1.6057 (estimate) |
| Fp | >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 Data
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| 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 |