Basic information
- CAS
94200-96-1- Standard SMILES
CCC1CC(=CC=CCOC(C)=O)CC(C)C1- InChIKey
ULDRZFWQYAWGLO-UHFFFAOYSA-N- Molecular formula
- C15H24O2
- Average molar mass
- 236.35 g/mol
- Monoisotopic mass
- 236.17763
Names & identifiers
- Preferred name
- 4-(3-Ethyl-5-methylcyclohexylidene)but-2-EN-1-YL acetate
- IUPAC
- 4-(3-ethyl-5-methylcyclohexylidene)but-2-enyl acetate
Names & synonyms
ULDRZFWQYAWGLO-UHFFFAOYSA-NDTXSID701182113NS000657962-Buten-1-ol, 4-(3-ethyl-5-methylcyclohexylidene)-, 1-acetate4-(3-ETHYL-5-METHYLCYCLOHEXYLIDENE)BUT-2-EN-1-YL ACETATE
Database identifiers
- CAS
94200-96-1- PubChem CID
- 3023973
- DTXSID
DTXSID701182113
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 302
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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