Basic information
- Standard SMILES
CCOC(=O)CCC1CC(=O)C1- InChIKey
BTDQXRFPXRGREK-UHFFFAOYSA-N- Molecular formula
- C9H14O3
- Average molar mass
- 170.21 g/mol
- Monoisotopic mass
- 170.0942943
Names & identifiers
- Preferred name
- Ethyl 3-(3-oxocyclobutyl)propanoate
- IUPAC
- ethyl 3-(3-oxocyclobutyl)propanoate
Names & synonyms
ethyl 3-(3-oxocyclobutyl)propanoate1380290-31-2SCHEMBL9106913BTDQXRFPXRGREK-UHFFFAOYSA-Nethyl3-(3-oxocyclobutyl)propanoateCS-B0987MFCD24713248D77232
Database identifiers
- PubChem CID
- 67775333
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 178
Related reactions
18 records
Linked notes
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