5-Chloroindole-2-carboxylic acid
- Product Name5-Chloroindole-2-carboxylic acid
- CAS10517-21-2
- MFC9H6ClNO2
- MW195.6
- EINECS234-050-1
- MOL File10517-21-2.mol
Chemical Properties
| Melting point | 287 °C (dec.) (lit.) |
| Boiling point | 449.7±25.0 °C(Predicted) |
| Density | 1.3228 (rough estimate) |
| refractive index | 1.5790 (estimate) |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| solubility | DMSO (Slightly), Methanol (Slightly) |
| pka | 4.26±0.30(Predicted) |
| form | Solid |
| color | Beige |
| BRN | 153229 |
| InChI | InChI=1S/C9H6ClNO2/c10-6-1-2-7-5(3-6)4-8(11-7)9(12)13/h1-4,11H,(H,12,13) |
| InChIKey | FUQOTYRCMBZFOL-UHFFFAOYSA-N |
| SMILES | N1C2=C(C=C(Cl)C=C2)C=C1C(O)=O |
| CAS DataBase Reference | 10517-21-2(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xn,Xi |
| Risk Statements | 22-36/37/38 |
| Safety Statements | 26-36-37/39 |
| WGK Germany | 3 |
| RTECS | NL5998400 |
| HazardClass | IRRITANT |
| HS Code | 29339990 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
