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| Related CAS: | 876590-73-7 (Deleted CAS) 28218-68-0 (rel-isomer) |
| IUPAC Name: | (3R,3aR,6R,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3,6-diol |
| Description: | Isomannide is a reagent used in the synthesis of new isomannide-based peptidomimetic as human tissue kallikrein 1 inhibitor using Ugi multicomponent reaction. It also functions as a chiral ligand for stereoselective synthesis. |
| Molecular Weight: | 146.14 |
| Molecular Formula: | C6H10O4 |
| Canonical SMILES: | C1C(C2C(O1)C(CO2)O)O |
| InChI: | InChI=1S/C6H10O4/c7-3-1-9-6-4(8)2-10-5(3)6/h3-8H,1-2H2/t3-,4-,5-,6-/m1/s1 |
| InChI Key: | KLDXJTOLSGUMSJ-KVTDHHQDSA-N |
| Boiling Point: | 95-99°C at 0.8 Torr |
| Melting Point: | 87-88°C |
| Purity: | ≥95% |
| Density: | 1.475±0.06 g/cm3 |
| Solubility: | Soluble in Chloroform (Slightly), Methanol (Slightly), Water |
| Appearance: | White to Off-white Solid |
| Storage: | Store at -20°C |
| MDL: | MFCD23701398 |
| LogP: | -1.49420 |
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