Basic information
- CAS
68092-44-4- Standard SMILES
CCCCCCCCCCCC1=NCC[N+]1(CCOCC(=O)[O-])CC(=O)[O-].[Cl-].[Na+].[Na+]- InChIKey
LPIXUSNUAMQYFN-UHFFFAOYSA-L- Molecular formula
- C20H35ClN2Na2O5
- Average molar mass
- 464.9 g/mol
- Monoisotopic mass
- 464.2029885
Names & identifiers
- Preferred name
- 1H-Imidazolium, 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-4,5-dihydro-2-undecyl-, chloride, sodium salt (1:1:2)
- IUPAC
- disodium;2-[1-[2-(carboxylatomethoxy)ethyl]-2-undecyl-4,5-dihydroimidazol-1-ium-1-yl]acetate;chloride
- English name
- disodium 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-undecyl-1H-imidazolium chloride
- Molecular formula
- C20H38Cl3N2Na2O5
- Molecular weight
- 538.86466
Names & synonyms
EINECS 268-457-068092-44-41H-Imidazolium, 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-4,5-dihydro-2-undecyl-, chloride, disodium salt1H-Imidazolium, 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-4,5-dihydro-2-undecyl-, chloride, sodium salt (1:1:2)1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-undecyl-, chloride, disodium salt1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-undecyl-, chloride, sodium salt (1:1:2)RefChem:79811LPIXUSNUAMQYFN-UHFFFAOYSA-LDTXSID301340488Disodium 1-(2-(carboxymethoxy)ethyl)-1-(carboxymethyl)-4,5-dihydro-2-undecyl-1H-imidazolium chloride1-[2-(Carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-undecyl-1H-imidazolium chloride sodium salt (1:1:2)disodium 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-undecyl-1H-imidazolium chloride
Database identifiers
- CAS
68092-44-4
Properties
Computed structural properties
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 15
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 470
Physicochemical properties
- EPA Substance Registry System
- 1 H-Imidazolium, · 1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-undecyl-, chloride, disodium salt (68092-44-4)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-undecyl-, chloride, disodium salt
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Imidazolium, 1-[2-(carboxymethoxy)ethyl]-1-(carboxymethyl)-4,5-dihydro-2-undecyl-, chloride, sodium salt (1:1:2): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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