147027-05-2
| Name | TRANS-5-ACETOXY-1,3-OXATHIOLANE-2-CARBOXYLIC ACID |
| CAS | 147027-05-2 |
| Molecular Formula | C6H8O5S |
| MDL Number | MFCD00799463 |
| Molecular Weight | 192.19 |
| MOL File | 147027-05-2.mol |
Chemical Properties
| Melting point | 110-112 °C (lit.) |
| Boiling point | 375.5±42.0 °C(Predicted) |
| density | 1.48±0.1 g/cm3(Predicted) |
| pka | 2.01±0.40(Predicted) |
| InChI | 1S/C6H8O5S/c1-3(7)10-4-2-12-6(11-4)5(8)9/h4,6H,2H2,1H3,(H,8,9)/t4-,6-/m0/s1 |
| InChIKey | WRUGSNIJLUOGQF-NJGYIYPDSA-N |
| SMILES | CC(=O)O[C@@H]1CS[C@H](O1)C(O)=O |
Safety Data
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| Storage Class | 13 - Non Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |