Basic information
- CAS
40617-60-5- Standard SMILES
CC1(C)OC2C(O)C(O)C3OC(C)(C)OC3C2O1- InChIKey
ZQZGHZYIHMUHSI-UHFFFAOYSA-N- Molecular formula
- C12H20O6
- Average molar mass
- 260.28 g/mol
- Monoisotopic mass
- 260.12598835
Names & identifiers
- Preferred name
- L-chiro-Inositol, 1,2:5,6-bis-O-(1-methylethylidene)-
- IUPAC
- 4,4,11,11-tetramethyl-3,5,10,12-tetraoxatricyclo[7.3.0.02,6]dodecane-7,8-diol
- English name
- 1 2:5 6-BIS-O-(1-METHYLETHYLIDENE-1L-
- Molecular formula
- C12H20O6
- Molecular weight
- 260.28
Names & synonyms
L-chiro-Inositol, 1,2:5,6-bis-O-(1-methylethylidene)-RefChem:79515765556-81-22,2,7,7-tetramethylhexahydrobenzo[1,2-d:3,4-d']bis[1,3]dioxole-4,5-diol1,2:5,6-Di-O-isopropylidene-L-chiro-inositol1,2:5,6-Di-O-isopropylidene-D-chiro-inositolNSC13342340617-60-5NSC1360284,4,11,11-tetramethyl-3,5,10,12-tetraoxatricyclo[7.3.0.02,6]dodecane-7,8-diol2,2,2,2-tetramethyl[?]-1,2-diol4,4,11,11-tetramethyl-3,5,10,12-tetraoxatricyclo[7.3.0.0?,?]dodecane-7,8-diol
Show more names
1 2:5 6-BIS-O-(1-METHYLETHYLIDENE-1L-1,2:5,6-BIS-O(1-METHYLETHYLIDENE)-1L-CHI
D-Chiro-inositol diacetonide1,3-Dioxolo[4,5-e][1,3]benzodioxole-4,5-diol, hexahydro-2,2,7,7-tetramethyl-D-chiro-Inositol, 1,2:5,6-bis-O-(1-methylethylidene)-SCHEMBL9767712DTXSID00961026ZQZGHZYIHMUHSI-UHFFFAOYSA-NMD10119MD10120
Database identifiers
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 77.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 320
Physicochemical properties
- Melting point
- 153 · 153-156 °C(lit.)
- Boiling point
- 395 · 395.0±42.0 °C(Predicted)
- Density
- 1.24 · 1.240±0.06 g/cm3(Predicted)
- pka
- 12.97 · 12.97±0.70(Predicted)
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
D-chiro-Inositol, 1,2:5,6-bis-O-(1-methylethylidene)-: Does not have an individual approval but may be used under an appropriate group standard
L-chiro-Inositol, 1,2:5,6-bis-O-(1-methylethylidene)-: Does not have an individual approval but may be used under an appropriate group standard
Safety data
- wgk
- 3
Chemistry & industry
Applications
Uses1,2:5,6-Di-O-isopropylidene-L-chiro-inositol is a derivative of inositol[1].
Suppliers1 total
BOC Sciences16314854226 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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