Basic information
- CAS
92369-26-1- Standard SMILES
CCOC(=O)/C=C/C1=C(C)CCCC1(C)C- InChIKey
SGHXYRRAFDSHBV-CMDGGOBGSA-N- Molecular formula
- C14H22O2
- Average molar mass
- 222.32 g/mol
- Monoisotopic mass
- 222.16197994
Names & identifiers
- Preferred name
- Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylate
- IUPAC
- ethyl (E)-3-(2,6,6-trimethylcyclohexen-1-yl)prop-2-enoate
Names & synonyms
92369-26-1Ethyl 3-(2,6,6-trimethylcyclohex-1-en-1-yl)acrylateEINECS 296-230-6SCHEMBL1761106NS00065389(E)-ethyl 3-(2,6,6-trimethylcyclohex-1-enyl)acrylate
Database identifiers
- CAS
92369-26-1- PubChem CID
- 6366199
- EC Number
- 296-230-6
- Nikkaji
- J333.382E、J756.869J
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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