3-Indoleacrylic acid
- Product Name3-Indoleacrylic acid
- CAS1204-06-4
- MFC11H9NO2
- MW187.19
- EINECS214-872-7
- MOL File1204-06-4.mol
Chemical Properties
| Melting point | 185 °C (dec.)(lit.) |
| Boiling point | 321.94°C (rough estimate) |
| Density | 1.1963 (rough estimate) |
| refractive index | 1.4900 (estimate) |
| storage temp. | room temp |
| form | powder |
| pka | 4.59±0.10(Predicted) |
| color | white to light yellow |
| Water Solubility | freely soluble |
| BRN | 6317 |
| InChI | InChI=1S/C11H9NO2/c13-11(14)6-5-8-7-12-10-4-2-1-3-9(8)10/h1-7,12H,(H,13,14) |
| InChIKey | PLVPPLCLBIEYEA-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C=CC1C2=C(NC=1)C=CC=C2 |
| CAS DataBase Reference | 1204-06-4(CAS DataBase Reference) |
| EPA Substance Registry System | 2-Propenoic acid, 3-(1H-indol-3-yl)- (1204-06-4) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36-37/39 |
| WGK Germany | 3 |
| RTECS | NL3680000 |
| TSCA | TSCA listed |
| HazardClass | IRRITANT |
| HS Code | 29339900 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
