Basic information
- Standard SMILES
CCOC(=O)C1C(=O)CC(C)CC1C- InChIKey
VIMDIFXDYYRGLI-UHFFFAOYSA-N- Molecular formula
- C11H18O3
- Average molar mass
- 198.26 g/mol
Names & identifiers
- Preferred name
- Ethyl 2,4-dimethyl-6-oxocyclohexane-1-carboxylate
- IUPAC
- ethyl 2,4-dimethyl-6-oxocyclohexane-1-carboxylate
Names & synonyms
ethyl 2,4-dimethyl-6-oxocyclohexane-1-carboxylate2323-21-9SCHEMBL1782540VIMDIFXDYYRGLI-UHFFFAOYSA-NAKOS014080353ethyl 2,4-dimethyl-6-oxocyclohexanecarboxylateEN300-1126812ethyl 2,4-dimethyl-6-oxo-cyclohexanecarboxylateethyl2,4-dimethyl-6-oxocyclohexane-1-carboxylate2,4-Dimethyl-6-oxocyclohexanecarboxylic acid, ethyl ester
Database identifiers
- PubChem CID
- 458120
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 235
Related reactions
2 records
Compound notes
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