3-Bromopropionitrile
ALDRICH/109231 - ≥98.0% (GC)
Synonym: 3-
CAS Number: 2417-90-5
Empirical Formula (Hill Notation): C3H4BrN
Molecular Weight: 133.97
EC Number: 219-332-4
MDL Number: MFCD00001951
Linear Formula: BrCH2CH2CN
Product Type: Chemical
| assay | ≥98.0% (GC) |
| bp | 76-78 °C/10 mmHg (lit.) |
| density | 1.615 g/mL at 25 °C (lit.) |
| InChI | 1S/C3H4BrN/c4-2-1-3-5/h1- |
| InChI key | CQZIEDXCLQOOEH-UHFFFAOYSA |
| Quality Level | 200  |
| refractive index | n |
| SMILES string | BrCCC#N |
| Application: | 3-Bromopropionitrile was used as the initiator in the atom transfer radical polymerization of acrylonitrile. 3-Bromopropionitrile was used in coupling reactions of a number of aromatic and heteroaromatic phenols with alkyl, acyl or benzoyl halides in acetonitrile with cesium fluoride-Celite. |
| Packaging: | 25, 100 g in glass bottle |
| Symbol |  GHS06 |
| Signal word | Danger |
| Hazard statements | H300 |
| Precautionary statements | P264 - P270 - P301 + P310 - P405 - P501 |
| Hazard Codes | T |
| Risk Statements | 23/24/25-36/37/38 |
| Safety Statements | 26-36/37-45 |
| RIDADR | UN 3276 6.1 / PGII |
| WGK Germany | WGK 3 |
| Flash Point(F) | 206.6 °F |
| Flash Point(C) | 97 °C |
| Purity | ≥98.0% (GC) |
| bp | 76-78 °C/10 mmHg (lit.) |
| Density | 1.615 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352100 |