3-(3,4-DIMETHYL-BENZENESULFONYL)-PROPIONIC ACID
- Product Name3-(3,4-DIMETHYL-BENZENESULFONYL)-PROPIONIC ACID
- CAS412936-84-6
- CBNumberCB3133459
- MFC11H14O4S
- MW242.29
- MDL NumberMFCD00450484
- MOL FileMol file
Chemical Properties
| Boiling point | 480.6±45.0 °C(Predicted) |
| Density | 1.265±0.06 g/cm3(Predicted) |
| form | solid |
| pka | 3.80±0.10(Predicted) |
| InChI | 1S/C11H14O4S/c1-8-3-4-10(7-9(8)2)16(14,15)6-5-11(12)13/h3-4,7H,5-6H2,1-2H3,(H,12,13) |
| InChIKey | BQBZVJSVOQMDRC-UHFFFAOYSA-N |
| SMILES | Cc1ccc(cc1C)S(=O)(=O)CCC(O)=O |
| UNSPSC Code | 12352106 |
| NACRES | NA.21 |
Safety
| Hazard Codes | Xi |
| WGK Germany | WGK 3 |
| HazardClass | IRRITANT |
| Storage Class | 11 - Combustible Solids |