structure of 2,2'-(Methylimino)bis(N,N-di-n-octylacetamide)

2,2'-(Methylimino)bis(N,N-di-n-octylacetamide)

CAS No.: 1000668-90-5
M. Wt: 594.010
M. Fa: C37H75N3O2
InChI Key: VYQLYCLTFJDXGV-UHFFFAOYSA-N
Appearance: Yellow Sticky Liquid

Names and Identifiers of 1000668-90-5

CAS Number

1000668-90-5

MDL Number

MFCD28386110

IUPAC Name

2-{[(dioctylcarbamoyl)methyl](methyl)amino}-N,N-dioctylacetamide

InChI

InChI=1S/C37H75N3O2/c1-6-10-14-18-22-26-30-39(31-27-23-19-15-11-7-2)36(41)34-38(5)35-37(42)40(32-28-24-20-16-12-8-3)33-29-25-21-17-13-9-4/h6-35H2,1-5H3

InChIKey

VYQLYCLTFJDXGV-UHFFFAOYSA-N

Canonical SMILES

CCCCCCCCN(CCCCCCCC)C(=O)CN(C)CC(=O)N(CCCCCCCC)CCCCCCCC

UNSPSC Code

12352100

Physical and chemical properties of 1000668-90-5

Boiling Point

660.3±40.0 °C at 760 mmHg

Density

0.9±0.1 g/cm3

Exact Mass

593.585938

Flash Point

202.9±19.7 °C

H Bond Acceptors

3

H Bond Donors

0

Index of Refraction

1.476

LogP

13.83

Molecular Formula

C37H75N3O2

Molecular Weight

594.010

Vapour Pressure

0.0±2.0 mmHg at 25°C

Safety Information of 1000668-90-5

Pictograms

Signal Word

Warning

Safety Data Sheet

Supports customized editing of SDS information and downloading in PDF documents.

Applications of 1000668-90-5

The primary application of 2,2'-(Methylimino)bis(N,N-di-n-octylacetamide) lies in its role as an efficient metal extractant. It is particularly effective in:

  • Isolation of Technetium: The compound is utilized for extracting technetium from aqueous solutions, which is crucial for various nuclear medicine applications.
  • Environmental Remediation: Potential use in extracting heavy metals from contaminated water sources.

Interaction Studies of 1000668-90-5

Interaction studies involving 2,2'-(Methylimino)bis(N,N-di-n-octylacetamide) focus on its ability to form complexes with various metal ions. These studies are essential for understanding its selectivity and efficiency as an extractant. The nature of these interactions can be explored through:

  • Spectroscopic Techniques: Such as UV-Vis or NMR spectroscopy to analyze complex formation.
  • Thermodynamic Studies: To assess stability constants and binding affinities with different metal ions.
Similar Compounds: Comparison

Several compounds exhibit similar properties to 2,2'-(Methylimino)bis(N,N-di-n-octylacetamide), particularly in their roles as extractants or ligands. Below is a comparison highlighting their uniqueness:

Compound NameMolecular FormulaMolecular WeightKey Features
1,3-Bis(2-ethylhexyl)thioureaC₁₂H₂₅N₃S241.41 g/molKnown for extracting heavy metals; less lipophilic than MIDOA
Di(2-ethylhexyl)phosphoric acidC₁₂H₂₅O₄P246.29 g/molCommonly used in solvent extraction; acidic nature aids in metal ion complexation
N,N-Di(n-octyl)acetamideC₂₄H₅₁N₃O393.65 g/molSimilar structure but lacks the methylimino bridge; used for various extractions

Retrosynthesis analysis of 1000668-90-5

  • Route#1

    Cas:1120-48-5
    Cas:4408-64-4
    Cas:1000668-90-5

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