Basic information
- Standard SMILES
COC(=O)C1CCCCC2(CCCCC2)C1=O- InChIKey
MJZRPNNBPWHNIA-UHFFFAOYSA-N- Molecular formula
- C14H22O3
- Average molar mass
- 238.32 g/mol
Names & identifiers
- Preferred name
- Methyl 7-oxospiro[5.6]dodecane-8-carboxylate
- IUPAC
- methyl 12-oxospiro[5.6]dodecane-11-carboxylate
Names & synonyms
Methyl 7-oxospiro[5.6]dodecane-8-carboxylateSCHEMBL3813382MJZRPNNBPWHNIA-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 57429461
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 303
Related reactions
3 records
Compound notes
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