4-tert-Butylbenzonitrile
- Product Name4-tert-Butylbenzonitrile
- CAS4210-32-6
- MFC11H13N
- MW159.23
- EINECS224-137-2
- MOL File4210-32-6.mol
Chemical Properties
| Melting point | 12-14 °C |
| Boiling point | 258 °C(lit.) |
| Density | 0.94 g/mL at 25 °C(lit.) |
| refractive index | n |
| Flash point | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| form | clear liquid |
| color | Colorless to Light yellow |
| Specific Gravity | 0.95 |
| BRN | 2080049 |
| InChI | InChI=1S/C11H13N/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,1-3H3 |
| InChIKey | IIZURLNRIMKEDL-UHFFFAOYSA-N |
| SMILES | C(#N)C1=CC=C(C(C)(C)C)C=C1 |
| LogP | 3.49 |
| CAS DataBase Reference | 4210-32-6(CAS DataBase Reference) |
| NIST Chemistry Reference | 4-t-Butylbenzonitrile(4210-32-6) |
Safety Information
| Hazard Codes | Xn,Xi |
| Risk Statements | 20/21/22 |
| Safety Statements | 36-36/37 |
| RIDADR | 3276 |
| WGK Germany | 2 |
| Hazard Note | Irritant |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29269090 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Acute Tox. 4 Oral |
