Basic information
- CAS
6942-10-5- Standard SMILES
CCOC(=O)C1(C)OC(=O)C2(CCCC2)O1- InChIKey
SOCZOSCROMDDED-UHFFFAOYSA-N- Molecular formula
- C11H16O5
- Average molar mass
- 228.24 g/mol
- Monoisotopic mass
- 228.09977361
Names & identifiers
- Preferred name
- Ethyl 2-methyl-4-oxo-1,3-dioxaspiro[4.4]nonane-2-carboxylate
- IUPAC
- ethyl 2-methyl-4-oxo-1,3-dioxaspiro[4.4]nonane-2-carboxylate
Names & synonyms
6942-10-5ethyl 2-methyl-4-oxo-1,3-dioxaspiro[4.4]nonane-2-carboxylateNSC57408DTXSID50288730NSC-57408
Database identifiers
- CAS
6942-10-5- PubChem CID
- 245447
- DTXSID
DTXSID50288730
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 318
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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