621-50-1
| Name | 3-NITROPHENYLACETONITRILE |
| CAS | 621-50-1 |
| EINECS(EC#) | 210-689-1 |
| Molecular Formula | C8H6N2O2 |
| MDL Number | MFCD00041249 |
| Molecular Weight | 162.15 |
| MOL File | 621-50-1.mol |
Chemical Properties
| Appearance | Pale Yellow Solid |
| Melting point | 60-62 °C(lit.) |
| Boiling point | 180 °C3 mm Hg(lit.) |
| density | 1.3264 (rough estimate) |
| refractive index | 1.5770 (estimate) |
| storage temp. | -20°C Freezer |
| solubility | Chloroform, Ethyl Acetate |
| form | Solid |
| color | Pale Yellow to Light Brown |
| InChI | 1S/C8H6N2O2/c9-5-4-7-2-1-3-8(6-7)10(11)12/h1-3,6H,4H2 |
| InChIKey | WAVKEPUFQMUGBP-UHFFFAOYSA-N |
| SMILES | [O-][N+](=O)c1cccc(CC#N)c1 |
| CAS DataBase Reference | 621-50-1(CAS DataBase Reference) |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H302+H312+H332 |
| Precautionary statements | P261-P264-P280-P301+P312-P302+P352+P312-P304+P340+P312 |
| Hazard Codes | Xn,Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| RTECS | AM1247000 |
| HazardClass | IRRITANT-HARMFUL |
| HS Code | 2926907090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral |