Basic information
- Standard SMILES
CC(=CCCC(C)=CCCC(C)=CC=C(C#N)C(C)C)CO- InChIKey
UDWHZWNMLSZTOS-UHFFFAOYSA-N- Molecular formula
- C20H31NO
- Average molar mass
- 301.5 g/mol
Names & identifiers
- Preferred name
- 14-Hydroxy-2-(1-methylethyl)-5,9,13-trimethyl-2,4,8,12-tetradecatetraenenitrile
- IUPAC
- 14-hydroxy-5,9,13-trimethyl-2-propan-2-yltetradeca-2,4,8,12-tetraenenitrile
Names & synonyms
SCHEMBL9421376UDWHZWNMLSZTOS-UHFFFAOYSA-N14-hydroxy-2-(1-methylethyl)-5,9,13-trimethyl-2,4,8,12-tetradecatetraenenitrile
Database identifiers
- PubChem CID
- 54348308
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 44 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 495
Related reactions
3 records
Compound notes
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