3-(2-Methylphenyl)-3-oxopropanenitrile
- Product Name3-(2-Methylphenyl)-3-oxopropanenitrile
- CAS35276-81-4
- MFC10H9NO
- MW159.18
- EINECS233-305-4
- MOL File35276-81-4.mol
Chemical Properties
| Melting point | 81-82 °C |
| Boiling point | 310.9±25.0 °C(Predicted) |
| Density | 1.081±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| form | solid |
| pka | 7.73±0.10(Predicted) |
| Appearance | Off-white to light yellow Solid |
| InChI | 1S/C10H9NO/c1-8-4-2-3-5-9(8)10(12)6-7-11/h2-5H,6H2,1H3 |
| InChIKey | DMTQMHCHBQZTOJ-UHFFFAOYSA-N |
| SMILES | N#CCC(C1=CC=CC=C1C)=O |
Safety Information
| WGK Germany | WGK 3 |
| HS Code | 2926907090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |
