5-Fluoroindole-2-carboxylic acid
- Product Name5-Fluoroindole-2-carboxylic acid
- CAS399-76-8
- MFC9H6FNO2
- MW179.15
- EINECS206-919-5
- MOL File399-76-8.mol
Chemical Properties
| Melting point | 259 °C (dec.)(lit.) |
| Boiling point | 422.2±25.0 °C(Predicted) |
| Density | 1.3231 (estimate) |
| storage temp. | Inert atmosphere,2-8°C |
| form | Crystalline Powder |
| pka | 4.27±0.30(Predicted) |
| color | Yellow-brown |
| Water Solubility | Insoluble |
| BRN | 153217 |
| InChI | InChI=1S/C9H6FNO2/c10-6-1-2-7-5(3-6)4-8(11-7)9(12)13/h1-4,11H,(H,12,13) |
| InChIKey | WTXBRZCVLDTWLP-UHFFFAOYSA-N |
| SMILES | N1C2=C(C=C(F)C=C2)C=C1C(O)=O |
| CAS DataBase Reference | 399-76-8(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi,F |
| Risk Statements | 36/37/38-15-10 |
| Safety Statements | 26-37/39-43-36-7/8 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 29339900 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
