Basic information
- Standard SMILES
O=C([O-])CCCCCCCC(=O)OCc1ccccc1.[Cs+]- InChIKey
ROYAHTWEKVEVIY-UHFFFAOYSA-M- Molecular formula
- C16H21CsO4
- Average molar mass
- 410.24 g/mol
- Monoisotopic mass
- 410.0494361
Names & identifiers
- Preferred name
- Cesium benzyl azelate
- IUPAC
- cesium 9-oxo-9-phenylmethoxynonanoate
Names & synonyms
Cesium benzyl azelateSCHEMBL8453847ROYAHTWEKVEVIY-UHFFFAOYSA-M
Database identifiers
- PubChem CID
- 86754149
Properties
Computed structural properties
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 288
Related reactions
1 records
Compound notes
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