3-(4-Cyanophenyl)propanoic acid
- Product Name3-(4-Cyanophenyl)propanoic acid
- CAS42287-94-5
- MFC10H9NO2
- MW175.18
- EINECS
- MOL File42287-94-5.mol
Chemical Properties
| Melting point | 138-143°C |
| Boiling point | 362.2±25.0 °C(Predicted) |
| Density | 1.21±0.1 g/cm3(Predicted) |
| storage temp. | Inert atmosphere,Room Temperature |
| pka | 4.50±0.10(Predicted) |
| form | solid |
| Appearance | White to off-white Solid |
| InChI | 1S/C10H9NO2/c11-7-9-3-1-8(2-4-9)5-6-10(12)13/h1-4H,5-6H2,(H,12,13) |
| InChIKey | RHIGOXBTMPLABF-UHFFFAOYSA-N |
| SMILES | N#Cc1ccc(cc1)CCC(=O)O |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 20/21/22-22 |
| Safety Statements | 36/37 |
| WGK Germany | 3 |
| HazardClass | 6.1 |
| HS Code | 2926907090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral |
