3,4:5,6-Di-O-isopropylidene-D-glucitol
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Basic information
- CAS
58846-25-6- Standard SMILES
CC1(C)O[C@H]([C@@H](O)CO)[C@@H]([C@H]2COC(C)(C)O2)O1- InChIKey
UISOMPJTKIBFPF-SGIHWFKDSA-N- Molecular formula
- C12H22O6
- Average molar mass
- 262.3 g/mol
- Monoisotopic mass
- 262.14163842
Names & identifiers
- Preferred name
- 3,4:5,6-Di-O-isopropylidene-D-glucitol
- IUPAC
- (1S)-1-[(4R,5R)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]ethane-1,2-diol
- English name
- 3,4:5,6-Di-O-isopropylidene-D-glucitol
- Molecular formula
- C12H22O6
- Molecular weight
- 262.3
Names & synonyms
58846-25-63,4:5,6-Di-O-isopropylidene-D-glucitol(1S)-1-[(4R,5R)-5-[(4R)-2,2-DIMETHYL-1,3-DIOXOLAN-4-YL]-2,2-DIMETHYL-1,3-DIOXOLAN-4-YL]ETHANE-1,2-DIOLSCHEMBL4419908MFCD18781999MD103273,4:5,6-di-o-isopropylidene-d-sorbitol(S)-1-((4R,4'R,5R)-2,2,2',2'-tetramethyl-[4,4'-bi(1,3-dioxolan)]-5-yl)ethane-1,2-diol3,4:5,6-Bis-O-(1-methylethylidene)-D-glucitol3,4:5,6-Di-O-isopropylidene-D-glucitol min. 99%D-Glucitol, 3,4:5,6-bis-O-(1-methylethylidene)-
Database identifiers
- CAS
58846-25-6- PubChem CID
- 13833634
- Nikkaji
- J2.757.804G
Properties
Computed structural propertiesFilling in
- XLogP
- -0.5
- Topological polar surface area
- 77.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 303
Related reactions
0 records
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Compound notes
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