Ethyl 5-(acetyloxy)-2,5-dimethyl-4-oxo-4,5-dihydrofuran-3-carboxylate

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Basic information

CAS: 53252-54-3
Standard SMILES: CCOC(=O)C1=C(C)OC(C)(OC(C)=O)C1=O
InChIKey: RKGRDXFLOPMTCD-UHFFFAOYSA-N
Molecular formula: C11H14O6
Average molar mass: 242.22 g/mol
Monoisotopic mass: 242.07903816

Names & identifiers

Preferred name: Ethyl 5-(acetyloxy)-2,5-dimethyl-4-oxo-4,5-dihydrofuran-3-carboxylate
IUPAC: ethyl 5-acetyloxy-2,5-dimethyl-4-oxofuran-3-carboxylate

Names & synonyms

53252-54-3Ethyl 5-acetoxy-2,5-dimethyl-4-oxo-4,5-dihydrofuran-3-carboxylateNSC360671DTXSID20320530Ethyl 5-(acetyloxy)-2,5-dimethyl-4-oxo-4,5-dihydrofuran-3-carboxylateNSC-360671

Database identifiers

CAS: 53252-54-3
PubChem CID: 338432
DTXSID: DTXSID20320530

Properties

Computed structural properties

XLogP: 1.1
Topological polar surface area: 78.9 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 5
Heavy atoms: 17
Formal charge: 0
Complexity: 408

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