Basic information
- Standard SMILES
CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.O=C([O-])Cc1ccccc1Nc1c(Cl)cccc1Cl- InChIKey
XJDRYTZGCQWNLA-UHFFFAOYSA-M- Molecular formula
- C36H58Cl2N2O2
- Average molar mass
- 621.8 g/mol
- Monoisotopic mass
- 620.3875345
Names & identifiers
- Preferred name
- Didecyldimethylammonium 2-[(2,6-dichlorophenyl)amino]benzeneacetate
- IUPAC
- 2-[2-(2,6-dichloroanilino)phenyl]acetate;didecyl(dimethyl)azanium
Names & synonyms
SCHEMBL5053879XJDRYTZGCQWNLA-UHFFFAOYSA-Mdidecyldimethylammonium 2-[(2,6-dichlorophenyl)amino]benzeneacetate
Database identifiers
- PubChem CID
- 69294875
Properties
Computed structural properties
- Topological polar surface area
- 52.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 21
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 498
Related reactions
2 records
Compound notes
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