Basic information
- CAS
23262-79-5- Standard SMILES
CC1(C)OCC([C@@H]2O[C@H]3OC(C)(C)O[C@H]3[C@H]2O)O1- InChIKey
KEJGAYKWRDILTF-MBGOZMDMSA-N- Molecular formula
- C12H20O6
- Average molar mass
- 260.28 g/mol
- Monoisotopic mass
- 260.12598835
Names & identifiers
- Preferred name
- Talofuranose, 1,2:5,6-di-O-isopropylidene-, beta-D-
- IUPAC
- (3aS,5R,6S,6aS)-5-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol
- English name
- 1-O,2-O:5-O,6-O-Bis(1-methylethylidene)-β-D-talofuranose
- Molecular formula
- C12H20O6
- Molecular weight
- 260.29
Names & synonyms
23262-79-5Talofuranose, 1,2:5,6-di-O-isopropylidene-, beta-D-β-D-Talofuranose, 1,2:5,6-bis-O-(1-methylethylidene)-1-O,2-O:5-O,6-O-Bis(1-methylethylidene)-β-D-talofuranose
Database identifiers
- CAS
23262-79-5- PubChem CID
- 31791
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 341
Physicochemical properties
- Boiling point
- 362.8 · 362.8±42.0 °C(Predicted)
- Density
- 1.214 · 1.214±0.06 g/cm3(Predicted)
- pka
- 13.15 · 13.15±0.60(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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