2417-90-5
3-Bromopropionitrile
CAS: 2417-90-5
Molecular Formula: C3H4BrN
2417-90-5 - Names and Identifiers
| Name | 3-Bromopropionitrile |
| Synonyms | 3-BROMOPROPIONITRILE 3-Bromopropionitrile 3-bromo-propionitril 3-Bromoethyl cyanide β-Bromopropionitrile 2-Cyanoethyl bromide 3-bromopropanenitrile 3-bromopropiononitrile beta-bromo-propionitril Propanenitrile,3-bromo- BETA-BROMOPROPIONITRILE beta-Bromopriopionitrile |
| CAS | 2417-90-5 |
| EINECS | 219-332-4 |
| InChI | InChI=1/C3H4BrN/c4-2-1-3-5/h1-2H2 |
2417-90-5 - Physico-chemical Properties
| Molecular Formula | C3H4BrN |
| Molar Mass | 133.97 |
| Density | 1.615g/mLat 25°C(lit.) |
| Boling Point | 76-78°C10mm Hg(lit.) |
| Flash Point | 207°F |
| Solubility | Soluble in ethanol, ether. |
| Vapor Presure | 0.317mmHg at 25°C |
| Appearance | clear liquid |
| Color | Colorless to Light yellow to Light orange |
| Exposure Limit | NIOSH: IDLH 25 mg/m3 |
| BRN | 1738565 |
| Storage Condition | Store below +30°C. |
| Refractive Index | n20/D 1.481(lit.) |
| Physical and Chemical Properties | Colorless or light yellow liquid. Boiling point 92 ℃(3.33kPa),81-83 ℃(2kPa),69 ℃(0.93kPa), relative density 1.6152, refractive index 1.4800. Soluble in ethanol and ether. |
2417-90-5 - Risk and Safety
| Hazard Symbols | T - Toxic |
| Risk Codes | R23/24/25 - Toxic by inhalation, in contact with skin and if swallowed. R36/37/38 - Irritating to eyes, respiratory system and skin. |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36/37 - Wear suitable protective clothing and gloves. S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) |
| UN IDs | UN 3276 6.1/PG 2 |
| WGK Germany | 3 |
| RTECS | UG1050000 |
| FLUKA BRAND F CODES | 8 |
| TSCA | Yes |
| HS Code | 29269090 |
| Hazard Class | 6.1 |
| Packing Group | III |
2417-90-5 - Reference Information
| EPA chemical information | Information provided by: ofmpub.epa.gov (external link) |
| use | for organic synthesis. |
| Production method | It is obtained by the reaction of β-hydroxypropiononitrile and phosphorus tribromide. β-hydroxypropionitrile and phosphorus tribromide are added to benzene in a 3:1 molar ratio. After the reaction, the solvent benzene was evaporated. The reactants are then distilled under reduced pressure to collect the 68-69 ℃(0.93kPa) fraction, namely 3-bromopropionitrile. The yield is 43%. |
| category | toxic substances |
| toxicity classification | highly toxic |
| acute toxicity | abdominal cavity-mouse LD50: 50 mg/kg |
| flammability hazard characteristics | open flame is combustible; high heat emits toxic bromide, nitrogen oxide and cyanide gas |
| storage and transportation characteristics | warehouse ventilation and low temperature drying; Store separately from oxidants, acids and food additives |
| fire extinguishing agent | foam, mist water, sand, carbon dioxide; Acid-base fire extinguishing agent |
Last Update：2024-04-09 15:16:45
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