Basic information
- Standard SMILES
CCOC(CCCCC(=O)O)c1ccc(OC)cc1- InChIKey
XYGWILIXJIYWLB-UHFFFAOYSA-N- Molecular formula
- C15H22O4
- Average molar mass
- 266.33 g/mol
- Monoisotopic mass
- 266.15180918
Names & identifiers
- Preferred name
- 6-Ethoxy-6-(4-methoxyphenyl)hexanoic acid
- IUPAC
- 6-ethoxy-6-(4-methoxyphenyl)hexanoic acid
Names & synonyms
SCHEMBL9309833XYGWILIXJIYWLB-UHFFFAOYSA-N6-ethoxy-6-(4-methoxyphenyl)hexanoic acid
Database identifiers
- PubChem CID
- 19088060
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 247
Related reactions
4 records
Linked notes
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