5-Nitroanthranilonitrile
- Product Name5-Nitroanthranilonitrile
- CAS17420-30-3
- MFC7H5N3O2
- MW163.13
- EINECS241-446-8
- MOL File17420-30-3.mol
Chemical Properties
| Melting point | 200-207 °C(lit.) |
| Boiling point | 290.19°C (rough estimate) |
| Density | 1.4141 (rough estimate) |
| refractive index | 1.5500 (estimate) |
| Flash point | 234 °C |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| solubility | DMSO (Slightly) |
| form | Solid |
| pka | -1.97±0.10(Predicted) |
| color | Dark Yellow |
| BRN | 1425714 |
| InChI | InChI=1S/C7H5N3O2/c8-4-5-3-6(10(11)12)1-2-7(5)9/h1-3H,9H2 |
| InChIKey | MGCGMYPNXAFGFA-UHFFFAOYSA-N |
| SMILES | C(#N)C1=CC([N+]([O-])=O)=CC=C1N |
| CAS DataBase Reference | 17420-30-3(CAS DataBase Reference) |
| EPA Substance Registry System | Benzonitrile, 2-amino-5-nitro- (17420-30-3) |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 20/21/22-36/37/38 |
| Safety Statements | 22-24/25-36-26 |
| WGK Germany | 2 |
| RTECS | BX2500000 |
| TSCA | TSCA listed |
| HS Code | 29269090 |
| Storage Class | 11 - Combustible Solids |
| Toxicity | mouse,LD50,oral,6710mg/kg (6710mg/kg),Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(1), Pg. 50, 1986. |
