Ethyl 3-ethyl-4,7-dimethyl-2,6-octadienoate
Basic information
- CAS
58535-01-6- Standard SMILES
CCOC(=O)C=C(CC)C(C)CC=C(C)C- InChIKey
NZYDJUTXGIGUQA-UHFFFAOYSA-N- Molecular formula
- C14H24O2
- Average molar mass
- 224.34 g/mol
- Monoisotopic mass
- 224.17763
Names & identifiers
- Preferred name
- Ethyl 3-ethyl-4,7-dimethyl-2,6-octadienoate
- IUPAC
- ethyl 3-ethyl-4,7-dimethylocta-2,6-dienoate
Names & synonyms
Ethyl 3-ethyl-4,7-dimethyl-2,6-octadienoate58535-01-6ethyl 3-ethyl-4,7-dimethylocta-2,6-dienoateSCHEMBL11679909DTXSID101263765DB-264961NS000532433-ethyl-4,7-dimethyl-2,6-octadienoic acid ethyl ester
Database identifiers
- CAS
58535-01-6- PubChem CID
- 94099
- DTXSID
DTXSID101263765- EC Number
- 261-314-3
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 270
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Related reactions
2 records
Compound notes
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