N,N,N,N-Tetraacetylethylenediamine - 92-94 % , CAS No.10543-57-4

CAS: 10543-57-4 Cat. No.: T115334 Molecular Weight: 228.25 Beilstein Registry Number: 1795711 EC Number: 234-123-8 PubChem CID: 66347

GRADE & PURITY 92-94 %

Synonyms

EC 234-123-8 | AKOS005207256 | J-001421 | N-Acetyl-N-[2-(diacetylamino)ethyl]acetamide | D92422 | N,N,N',N'-Tetraacetylethylenediamine, technical, >=90% (CHN) | SCHEMBL20390 | Tetraacetylethylenediamine | UNII-P411ED0N2B | n,n,n',n'-tetraacetyl ethylenedi

Storage

Room temperature

Shipped In

Normal

Overview

application：

N, N, N′, N′-Tetraacetylethylenediamine (TAED) can be used as a reagent:

Along with sodium perborate and sodium bicarbonate for the oxidation of primary aliphatic amines to aliphatic C-nitroso compounds.

In combination with sodium percarbonate to deliver peracetic acid in situ for Baeyer-Villiger oxidation.

It can also be used as a peroxide bleach activator in laundry detergents and in textile chemistry applications.

Specifications

Synonyms

EC 234-123-8 | AKOS005207256 | J-001421 | N-Acetyl-N-[2-(diacetylamino)ethyl]acetamide | D92422 | N, N, N', N'-Tetraacetylethylenediamine, technical, >=90% (CHN) | SCHEMBL20390 | Tetraacetylethylenediamine | UNII-P411ED0N2B | n, n, n', n'-tetraacetyl ethylenedi

Specifications & Purity

92-94 %

Storage

Room temperature

Shipped In

Normal

Names and Identifiers

• Pubchem Sid: 488183784
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488183784
• Canonical Smiles: CC(=O)N(CCN(C(=O)C)C(=O)C)C(=O)C
• IUPAC Name: N-acetyl-N-[2-(diacetylamino)ethyl]acetamide
• InChIKey: BGRWYDHXPHLNKA-UHFFFAOYSA-N
• INCHI: 1S/C10H16N2O4/c1-7(13)11(8(2)14)5-6-12(9(3)15)10(4)16/h5-6H2,1-4H3
• Isomeric SMILES: CC(=O)N(CCN(C(=O)C)C(=O)C)C(=O)C
• WGK Germany: 1
• PubChem CID: 66347
• Molecular Weight: 228.25
• Beilstein: 1795711
• Reaxy-Rn: 1795711

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid imides
          • Level6 N-substituted carboxylic acid imides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid imides
• Direct Parent: N-substituted carboxylic acid imides
• Alternative Parents: Dicarboximides Acetamides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carboxylic acid imide, n-substituted - Acetamide - Dicarboximide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as n-substituted carboxylic acid imides. These are compounds comprising an N-substituted carboxylic acid imide group, with the general structure R1N(C(R2)=O)C(R3)=O (R2,R3=H, alkyl, aryl; R1=Anything but H).
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Solubility: Soluble in chloroform and methylenechloride. Slightly soluble in water and acetone.
• Melt Point(°C): 152°C
• Molecular Weight: 228.240 g/mol
• XLogP3: -1.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 228.111 Da
• Monoisotopic Mass: 228.111 Da
• Topological Polar Surface Area: 74.800 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 265.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

References

1. Yuan-Bin Zheng, Jian-Xin Jia, Wei Shi, Jia-Jie Long.  (2021)  A sustainable one-step pretreatment of cotton gray fabric with 18-crown-6 as phase transfer in supercritical carbon dioxide.  JOURNAL OF SUPERCRITICAL FLUIDS,      [PMID:] [10.1016/j.supflu.2021.105269]

2. Weiming Wang, Meng Xu, Jiahao Lou, Aixue Dong.  (2020)  Changes in physicomechanical properties and structures of jute fibers after tetraacetylethylenediamine activated hydrogen peroxide treatment.  Journal of Materials Research and Technology-JMR&T,      [PMID:] [10.1016/j.jmrt.2020.10.096]

3. Wang Xiaoyan, Fu Jiangpeng, Gu Fuyang, Du Jinmei, Xiao Guowei, Jiang Yang, Shao Dongyan, Xu Changhai.  (2024)  Roles of Electrostatic Interactions in the Peroxide System for Bleaching of Cotton Fabric.  FIBERS AND POLYMERS,      [PMID:] [10.1007/s12221-024-00628-y]