98276-91-6
| Name | CHEMBRDG-BB 4009838 |
| CAS | 98276-91-6 |
| Molecular Formula | C7H8N2O3S |
| MDL Number | MFCD00725639 |
| Molecular Weight | 200.21 |
| MOL File | 98276-91-6.mol |
Chemical Properties
| Melting point | 213-214 °C |
| Boiling point | 389.2±44.0 °C(Predicted) |
| density | 1.52±0.1 g/cm3(Predicted) |
| form | solid |
| pka | 2.92±0.10(Predicted) |
| InChI | 1S/C7H8N2O3S/c1-4-2-5(10)9-7(8-4)13-3-6(11)12/h2H,3H2,1H3,(H,11,12)(H,8,9,10) |
| InChIKey | LVGJFVUANDOIKJ-UHFFFAOYSA-N |
| SMILES | S(CC(=O)O)c1[nH][c](cc(n1)C)=O |