4-Nitrocinnamic acid
- Product Name4-Nitrocinnamic acid
- CAS619-89-6
- MFC9H7NO4
- MW193.16
- EINECS210-617-9
- MOL File619-89-6.mol
Chemical Properties
| Melting point | 200-202 °C(lit.) |
| Boiling point | 329.36°C (rough estimate) |
| Density | 1.4058 (rough estimate) |
| refractive index | 1.5200 (estimate) |
| storage temp. | Sealed in dry,Store in freezer, under -20°C |
| solubility | DMSO |
| form | Solid |
| pka | 4.07±0.10(Predicted) |
| color | Yellow |
| Water Solubility | insoluble |
| InChI | InChI=1S/C9H7NO4/c11-9(12)6-3-7-1-4-8(5-2-7)10(13)14/h1-6H,(H,11,12) |
| InChIKey | XMMRNCHTDONGRJ-ZZXKWVIFSA-N |
| SMILES | C(O)(=O)C=CC1=CC=C([N+]([O-])=O)C=C1 |
| CAS DataBase Reference | 619-89-6(CAS DataBase Reference) |
| NIST Chemistry Reference | trans-4-Nitrocinnmic acid(619-89-6) |
| EPA Substance Registry System | 2-Propenoic acid, 3-(4-nitrophenyl)- (619-89-6) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 22-24/25 |
| WGK Germany | 3 |
| RTECS | GE0352000 |
| HazardClass | IRRITANT |
| HS Code | 29163990 |
