Basic information
- Standard SMILES
CC(C)=CCC/C(C)=C/COc1ccc(C(=O)O)c(O)c1- InChIKey
RPHGPEPWDJACFX-UKTHLTGXSA-N- Molecular formula
- C17H22O4
- Average molar mass
- 290.4 g/mol
- Monoisotopic mass
- 290.15180918
Names & identifiers
- Preferred name
- 4-{(2E)-3,7-dimethylocta-2,6-dienyloxy}-2-hydroxybenzoic acid
- IUPAC
- 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-2-hydroxybenzoic acid
Names & synonyms
SCHEMBL3303212RPHGPEPWDJACFX-UKTHLTGXSA-N4-{(2E)-3,7-dimethylocta-2,6-dienyloxy}-2-hydroxybenzoic acid
Database identifiers
- PubChem CID
- 10424313
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 394
Related reactions
3 records
Compound notes
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