Basic information
- CAS
93840-88-1- Standard SMILES
CC1=CCC(C(C)/C=C/CCC=O)CC1- InChIKey
MAFITFSDTGHHDL-GQCTYLIASA-N- Molecular formula
- C14H22O
- Average molar mass
- 206.32 g/mol
- Monoisotopic mass
- 206.16706532
Names & identifiers
- Preferred name
- 6-(4-Methyl-3-cyclohexen-1-yl)hept-4-enal
- IUPAC
- (E)-6-(4-methylcyclohex-3-en-1-yl)hept-4-enal
Names & synonyms
6-(4-Methyl-3-cyclohexen-1-yl)hept-4-enal93840-88-1EINECS 298-955-3
Database identifiers
- CAS
93840-88-1- PubChem CID
- 6366261
- EC Number
- 298-955-3
- Nikkaji
- J317.676B
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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