3,3'-Sulfonyldianiline
- Product Name3,3'-Sulfonyldianiline
- CAS599-61-1
- MFC12H12N2O2S
- MW248.3
- EINECS209-967-5
- MOL File599-61-1.mol
Chemical Properties
| Melting point | 170-173 °C(lit.) |
| Boiling point | 542.8±35.0 °C(Predicted) |
| Density | 1.2701 (rough estimate) |
| vapor pressure | 0.002Pa at 20℃ |
| refractive index | 1.5950 (estimate) |
| storage temp. | Store below +30°C. |
| solubility | DMSO (Slightly), Methanol (Slightly) |
| form | Solid |
| pka | 3.16±0.10(Predicted) |
| color | White |
| Water Solubility | slightly soluble |
| BRN | 2215938 |
| InChI | 1S/C12H12N2O2S/c13-9-3-1-5-11(7-9)17(15,16)12-6-2-4-10(14)8-12/h1-8H,13-14H2 |
| InChIKey | LJGHYPLBDBRCRZ-UHFFFAOYSA-N |
| SMILES | Nc1cccc(c1)S(=O)(=O)c2cccc(N)c2 |
| LogP | 0.76 at 25℃ |
| CAS DataBase Reference | 599-61-1(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzenamine, 3,3'-sulfonylbis-(599-61-1) |
Safety Information
| Hazard Codes | Xi,Xn |
| Risk Statements | 36/37/38-22 |
| Safety Statements | 26-37/39 |
| RIDADR | UN 3077 9 / PGIII |
| WGK Germany | 3 |
| RTECS | BY8800000 |
| TSCA | TSCA listed |
| HazardClass | 9 |
| HS Code | 29309070 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Aquatic Chronic 2 STOT RE 2 |
