Cyclohexane-1,2,4,5-tetrayl tetraacetate
Basic information
- CAS
92298-57-2- Standard SMILES
CC(=O)OC1CC(OC(C)=O)C(OC(C)=O)CC1OC(C)=O- InChIKey
MCRKABDCFOWPHD-UHFFFAOYSA-N- Molecular formula
- C14H20O8
- Average molar mass
- 316.3 g/mol
- Monoisotopic mass
- 316.11581759
Names & identifiers
- Preferred name
- Cyclohexane-1,2,4,5-tetrayl tetraacetate
- IUPAC
- (2,4,5-triacetyloxycyclohexyl) acetate
- English name
- 1,2,4,5-Cyclohexanetetrayl tetraacetate
- Molecular formula
- C14H20O8
- Molecular weight
- 316.3
Names & synonyms
cyclohexane-1,2,4,5-tetrayl tetraacetate92298-57-2DTXSID80298105RefChem:335219DTXCID70249242(2,4,5-triacetyloxycyclohexyl) acetateNSC120587MCRKABDCFOWPHD-UHFFFAOYSA-NNSC-1205871,4,2,5 cyclohexanetetrol, tetra-acetate1,2,4,5-Cyclohexanetetrayl tetraacetate1,2,4,5-Cyclohexanetetrol, 1,2,4,5-tetraacetate
Database identifiers
- CAS
92298-57-2- PubChem CID
- 274512
- DTXSID
DTXSID80298105
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 376
Physicochemical properties
- InChI
- InChI=1S/C14H20O8/c1-7(15)19-11-5-13(21-9(3)17)14(22-10(4)18)6-12(11)20-8(2)16/h11-14H,5-6H2,1-4H3
- InChIKey
- MCRKABDCFOWPHD-UHFFFAOYSA-N
- SMILES
- C1(OC(=O)C)CC(OC(=O)C)C(OC(=O)C)CC1OC(=O)C
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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