1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione
Basic information
- CAS
62796-84-3- Standard SMILES
O=C1COCC(=O)OCCOCCOCCOCCO1- InChIKey
GDPHFFJDDVZGDK-UHFFFAOYSA-N- Molecular formula
- C12H20O8
- Average molar mass
- 292.28 g/mol
- Monoisotopic mass
- 292.11581759
Names & identifiers
- Preferred name
- 1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione
- IUPAC
- 1,4,7,10,13,16-hexaoxacyclooctadecane-2,6-dione
Names & synonyms
1,4,7,10,13,16-hexaoxacyclooctadecane-2,6-dione62796-84-3DTXSID40315842RefChem:219880DTXCID80266965NSC297851SCHEMBL11522424NSC-2978511,4,7,10,13,16-hexaoxa-2,6-cyclooctadecanedione
Database identifiers
- CAS
62796-84-3- PubChem CID
- 326430
- DTXSID
DTXSID40315842- Nikkaji
- J480.617D
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 89.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 255
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Related reactions
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Compound notes
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