Basic information
- Standard SMILES
CCOc1cc(CCC#N)ccc1OC1CCCCC1- InChIKey
ZKKSCYZJXBBFHJ-UHFFFAOYSA-N- Molecular formula
- C17H23NO2
- Average molar mass
- 273.37 g/mol
Names & identifiers
- Preferred name
- 3-(3-Ethoxy-4-cyclohexyloxyphenyl)propionitrile
- IUPAC
- 3-(4-cyclohexyloxy-3-ethoxyphenyl)propanenitrile
Names & synonyms
ZKKSCYZJXBBFHJ-UHFFFAOYSA-N3-(3-ethoxy-4-cyclohexyloxyphenyl)propionitrile
Database identifiers
- PubChem CID
- 86756342
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 42.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 316
Related reactions
1 records
Compound notes
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