28166-41-8
| Name | ALPHA-CYANO-4-HYDROXYCINNAMIC ACID |
| CAS | 28166-41-8 |
| EINECS(EC#) | 248-879-1 |
| Molecular Formula | C10H7NO3 |
| MDL Number | MFCD00004204 |
| Molecular Weight | 189.17 |
| MOL File | 28166-41-8.mol |
Chemical Properties
| Appearance | yellow crystalline powder |
| Melting point | 245-250 °C(lit.) |
| Boiling point | 324.41°C (rough estimate) |
| density | 1.3175 (rough estimate) |
| refractive index | 1.5400 (estimate) |
| storage temp. | 2-8°C |
| solubility | methanol: 10 mg/mL, clear |
| form | powder |
| pka | 0.85±0.10(Predicted) |
| color | yellow |
| Water Solubility | H2O: slightly soluble methanol: water: soluble polar organic solvents: soluble |
| BRN | 3271427 |
| InChI | InChI=1S/C10H7NO3/c11-6-8(10(13)14)5-7-1-3-9(12)4-2-7/h1-5,12H,(H,13,14) |
| InChIKey | AFVLVVWMAFSXCK-VMPITWQZSA-N |
| SMILES | C(O)(=O)C(C#N)=CC1=CC=C(O)C=C1 |
| CAS DataBase Reference | 28166-41-8(CAS DataBase Reference) |
| Absorption | ≥2000 at 337nm (mol. absorption) |