(2,3,4,5-Tetraacetyloxy-6-hydroxycyclohexyl) benzoate
Basic information
- CAS
6730-17-2- Standard SMILES
CC(=O)OC1C(O)C(OC(=O)c2ccccc2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O- InChIKey
HOEDJCIYWSSOHH-UHFFFAOYSA-N- Molecular formula
- C21H24O11
- Average molar mass
- 452.4 g/mol
- Monoisotopic mass
- 452.13186158
Names & identifiers
- Preferred name
- (2,3,4,5-Tetraacetyloxy-6-hydroxycyclohexyl) benzoate
- IUPAC
- (2,3,4,5-tetraacetyloxy-6-hydroxycyclohexyl) benzoate
Names & synonyms
6730-17-2(2,3,4,5-tetraacetyloxy-6-hydroxycyclohexyl) benzoateNSC269407DTXSID90313358NSC-2694072,3,4,5-Tetrakis(acetyloxy)-6-hydroxycyclohexyl benzoate
Database identifiers
- CAS
6730-17-2- PubChem CID
- 320734
- DTXSID
DTXSID90313358
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 152 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 11
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 727
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Compound notes
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