4-Cyanophenol
- Product Name4-Cyanophenol
- CAS767-00-0
- MFC7H5NO
- MW119.12
- EINECS212-175-2
- MOL File767-00-0.mol
Chemical Properties
| Melting point | 110-113 °C(lit.) |
| Boiling point | 146 °C / 2mmHg |
| Density | 1.1871 (rough estimate) |
| refractive index | 1.5800 (estimate) |
| storage temp. | Inert atmosphere,Room Temperature |
| solubility | methanol: 0.1 g/mL, clear |
| form | Crystalline Powder |
| pka | 7.97(at 25℃) |
| color | Off-white to beige-gray |
| Water Solubility | slightly soluble |
| BRN | 386130 |
| Henry's Law Constant | 1.4×104 mol/(m3Pa) at 25℃, Hilal et al. (2008) |
| Stability | Stable. Incompatible with strong oxidizing agents. |
| InChI | 1S/C7H5NO/c8-5-6-1-3-7(9)4-2-6/h1-4,9H |
| InChIKey | CVNOWLNNPYYEOH-UHFFFAOYSA-N |
| SMILES | Oc1ccc(cc1)C#N |
| CAS DataBase Reference | 767-00-0(CAS DataBase Reference) |
| NIST Chemistry Reference | 4-Hydroxybenzoic acid nitrile(767-00-0) |
Safety Information
| Hazard Codes | Xn,Xi |
| Risk Statements | 22-36/37/38 |
| Safety Statements | 26-36-45-24/25 |
| WGK Germany | 3 |
| RTECS | DI4375000 |
| Hazard Note | Irritant |
| TSCA | TSCA listed |
| HS Code | 29269095 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
