3119-02-6
| Name | 4-CYANOBENZENE-1-SULFONAMIDE |
| CAS | 3119-02-6 |
| EINECS(EC#) | 221-492-5 |
| Molecular Formula | C7H6N2O2S |
| MDL Number | MFCD00178767 |
| Molecular Weight | 182.2 |
| MOL File | 3119-02-6.mol |
Chemical Properties
| Melting point | 166 °C |
| Boiling point | 400.7±47.0 °C(Predicted) |
| density | 1.3827 (rough estimate) |
| refractive index | 1.6000 (estimate) |
| RTECS | DB1582000 |
| storage temp. | Sealed in dry,Room Temperature |
| form | solid |
| pka | 9.57±0.10(Predicted) |
| color | Off-white |
| Water Solubility | 1.111g/L(15 ºC) |
| InChI | 1S/C7H6N2O2S/c8-5-6-1-3-7(4-2-6)12(9,10)11/h1-4H,(H2,9,10,11) |
| InChIKey | UZECCNDOASGYNH-UHFFFAOYSA-N |
| SMILES | NS(=O)(=O)c1ccc(cc1)C#N |
| CAS DataBase Reference | 3119-02-6(CAS DataBase Reference) |
Safety Data
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| RIDADR | 3276 |
| WGK Germany | WGK 3 |
| Hazard Note | Harmful |
| HazardClass | IRRITANT |
| HS Code | 29350090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
