1376616-67-9
| Name | 4-Thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 6-acetyl-7-oxo-3-[(2R)-tetrahydro-2-furanyl]-, (5R,6S)- |
| CAS | 1376616-67-9 |
| Molecular Formula | C12H13NO5S |
| Molecular Weight | 283.3 |
| MOL File | 1376616-67-9.mol |
Chemical Properties
| Boiling point | 569.3±50.0 °C(Predicted) |
| density | 1.56±0.1 g/cm3(Predicted) |
| pka | 3.83±0.40(Predicted) |
| InChI | InChI=1S/C12H13NO5S/c1-5(14)7-10(15)13-8(12(16)17)9(19-11(7)13)6-3-2-4-18-6/h6-7,11H,2-4H2,1H3,(H,16,17)/t6-,7+,11-/m1/s1 |
| InChIKey | FYGIRZDFDNYWPZ-PTZCXBDSSA-N |
| SMILES | N12[C@@]([H])([C@@H](C(C)=O)C1=O)SC([C@H]1CCCO1)=C2C(O)=O |