1,4,8,11-Tetraoxacyclotetradecane-5,7,12,14-tetrone

HCID 574635

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Basic information

CAS: 21620-29-1
Standard SMILES: O=C1CC(=O)OCCOC(=O)CC(=O)OCCO1
InChIKey: CTKMTNCPSWUZPW-UHFFFAOYSA-N
Molecular formula: C10H12O8
Average molar mass: 260.2 g/mol
Monoisotopic mass: 260.05321734

Names & identifiers

Preferred name: 1,4,8,11-Tetraoxacyclotetradecane-5,7,12,14-tetrone
IUPAC: 1,4,8,11-tetraoxacyclotetradecane-5,7,12,14-tetrone
English name: 1,4,8,11-Tetraoxacyclotetradecane-5,7,12,14-tetrone
Molecular formula: C10H12O8
Molecular weight: 260.2

Names & synonyms

1,4,8,11-Tetraoxacyclotetradecane-5,7,12,14-tetrone21620-29-1DTXSID80341640RefChem:219949DTXCID00292721Malonic acid, bimol. cyclic ethylene esterSCHEMBL12158580CTKMTNCPSWUZPW-UHFFFAOYSA-NMalonic acid bimol cyclic ethylene ester

Database identifiers

CAS: 21620-29-1
PubChem CID: 574635
DTXSID: DTXSID80341640
Nikkaji: J104.949F

Properties

Computed structural properties

XLogP: -0.2
Topological polar surface area: 105 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 8
Rotatable bonds: 0
Heavy atoms: 18
Formal charge: 0
Complexity: 282

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