4-Bromobenzonitrile
- Product Name4-Bromobenzonitrile
- CAS623-00-7
- MFC7H4BrN
- MW182.02
- EINECS210-764-9
- MOL File623-00-7.mol
Chemical Properties
| Melting point | 110-115 °C(lit.) |
| Boiling point | 235-237 °C(lit.) |
| Density | 1,562 g/cm3 |
| refractive index | 1.5999 (estimate) |
| Flash point | 130°C |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | 0.2g/l |
| form | Powder or Flakes |
| color | White to light yellow or flakes |
| Water Solubility | Very slightly soluble in water(0.2g/L). Soluble in alcohol and ether. |
| BRN | 2041518 |
| InChI | 1S/C7H4BrN/c8-7-3-1-6(5-9)2-4-7/h1-4H |
| InChIKey | HQSCPPCMBMFJJN-UHFFFAOYSA-N |
| SMILES | Brc1ccc(cc1)C#N |
| LogP | 2.3 at 22.5℃ and pH7 |
| CAS DataBase Reference | 623-00-7(CAS DataBase Reference) |
| NIST Chemistry Reference | 4-Bromobenzoic acid nitrile(623-00-7) |
Safety Information
| Hazard Codes | Xn,T,Xi |
| Risk Statements | 22-36/37/38-20/21/22 |
| Safety Statements | 61-36/37/39-26-24/25 |
| RIDADR | UN 3439 6.1/PG 3 |
| WGK Germany | 2 |
| RTECS | DI2460000 |
| Hazard Note | Toxic/Irritant |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29269095 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Oral Aquatic Chronic 3 Eye Irrit. 2 |
