Basic information
- Standard SMILES
CCCCCCCCCCOc1cc(Oc2ccccc2C(=O)OCC)ccc1CCC(=O)OCC- InChIKey
LNFSNNCXYPQFHZ-UHFFFAOYSA-N- Molecular formula
- C30H42O6
- Average molar mass
- 498.6 g/mol
Names & identifiers
- Preferred name
- 2-(Decyloxy)-4-[2-(ethoxycarbonyl)phenoxy]benzenepropanoic acid ethyl ester
- IUPAC
- ethyl 2-[3-decoxy-4-(3-ethoxy-3-oxopropyl)phenoxy]benzoate
Names & synonyms
SCHEMBL9147877LNFSNNCXYPQFHZ-UHFFFAOYSA-N2-(decyloxy)-4-[2-(ethoxycarbonyl)phenoxy]benzenepropanoic acid ethyl ester
Database identifiers
- PubChem CID
- 15718062
Properties
Computed structural properties
- XLogP
- 8.6
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 20
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 594
Related reactions
2 records
Compound notes
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