(6-Benzoyloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl)methyl benzoate
Basic information
- CAS
3080-31-7- Standard SMILES
CC1(C)OC2OC(COC(=O)c3ccccc3)C(OC(=O)c3ccccc3)C2O1- InChIKey
ZYVSFZHNWSDHKK-UHFFFAOYSA-N- Molecular formula
- C22H22O7
- Average molar mass
- 398.4 g/mol
- Monoisotopic mass
- 398.13655304
Names & identifiers
- Preferred name
- (6-Benzoyloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl)methyl benzoate
- IUPAC
- (6-benzoyloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl)methyl benzoate
Names & synonyms
3,5-Di-O-benzoyl-1,2-O-isopropylidene-alpha-D-ribofuranose3080-31-7NSC852123,5-di-o-benzoyl-1,2-o-(1-methylethylidene)pentofuranose(6-benzoyloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl)methyl benzoateOprea1_387168SCHEMBL14356269DTXSID20953009NSC23598NSC-23598NSC-85212SR-01000513641
Show more names
SR-01000513641-1
Database identifiers
- CAS
3080-31-7- PubChem CID
- 229736
- DTXSID
DTXSID20953009
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 80.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 592
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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