4-Bromophenylacetonitrile
- Product Name4-Bromophenylacetonitrile
- CAS16532-79-9
- MFC8H6BrN
- MW196.04
- EINECS240-602-2
- MOL File16532-79-9.mol
Chemical Properties
| Melting point | 47-49 °C (lit.) |
| Boiling point | 116-118°C 3mm |
| Density | 1.49 |
| refractive index | 1.6550 (estimate) |
| Flash point | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Chloroform (Sparingly), Ethyl Acetate (Sparingly) |
| form | Crystalline Mass |
| color | Colorless to pale brown |
| Water Solubility | slightly soluble |
| BRN | 1861069 |
| Exposure limits | NIOSH: IDLH 25 mg/m3 |
| InChI | 1S/C8H6BrN/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5H2 |
| InChIKey | MFHFWRBXPQDZSA-UHFFFAOYSA-N |
| SMILES | Brc1ccc(CC#N)cc1 |
| CAS DataBase Reference | 16532-79-9(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzeneacetonitrile, 4-bromo-(16532-79-9) |
| EPA Substance Registry System | 4-Bromobenzyl cyanide (16532-79-9) |
Safety Information
| Hazard Codes | Xn,Xi |
| Risk Statements | 20/21/22-36/37/38-20/21/22/36/37/39 |
| Safety Statements | 26-36/37/39-38-26/36/37/39 |
| RIDADR | 3276 |
| WGK Germany | 3 |
| RTECS | AL8090000 |
| Hazard Note | Irritant |
| TSCA | TSCA listed |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29269090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Aquatic Chronic 3 Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
