2,4:3,5-Diethylidene-l-xylitol
Basic information
- CAS
7473-46-3- Standard SMILES
CC1OC(CO)C2OC(C)OCC2O1- InChIKey
JIWQJFYKFLJFDX-UHFFFAOYSA-N- Molecular formula
- C9H16O5
- Average molar mass
- 204.22 g/mol
- Monoisotopic mass
- 204.09977361
Names & identifiers
- Preferred name
- 2,4:3,5-Diethylidene-l-xylitol
- IUPAC
- (2,6-dimethyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)methanol
Names & synonyms
7473-46-32,4:3,5-Diethylidene-l-xylitolNSC400286DTXSID80322050JIWQJFYKFLJFDX-UHFFFAOYSA-NNSC-400286(2,6-Dimethyltetrahydro-2H,6H-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)methanol
Database identifiers
- CAS
7473-46-3- PubChem CID
- 343786
- DTXSID
DTXSID80322050
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 57.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 198
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…