2-Phenylacetoacetonitrile
- Product Name2-Phenylacetoacetonitrile
- CAS4468-48-8
- MFC10H9NO
- MW159.19
- EINECS224-737-4
- MOL File4468-48-8.mol
Chemical Properties
| Melting point | 92-94 °C(lit.) |
| Boiling point | 284.68°C (rough estimate) |
| Density | 1.1202 (rough estimate) |
| refractive index | 1.5460 (estimate) |
| storage temp. | -20°C Freezer |
| solubility | DMF: 30 mg/ml; DMF:PBS (pH 7.2); (1:7): 0.12 mg/ml; DMSO: 25 mg/ml; Ethanol: 15 mg/ml |
| form | A crystalline solid |
| color | Crystals from EtOH (aq) or EtOAc/pet ether |
| CAS DataBase Reference | 4468-48-8(CAS DataBase Reference) |
| EPA Substance Registry System | Benzeneacetonitrile, .alpha.-acetyl- (4468-48-8) |
Safety Information
| Hazard Codes | Xn,Xi |
| Risk Statements | 20/21/22-36/37/38 |
| Safety Statements | 26-37/39 |
| RIDADR | UN 3439 6.1/PG 3 |
| WGK Germany | 3 |
| RTECS | AL7708000 |
| HazardClass | IRRITANT |
| HS Code | 2926907090 |
| Toxicity | LD50 ipr-mus: 200 mg/kg NTIS** AD277-689 |