基本情報
- 標準SMILES
CC(=O)N(CCN(C(C)=O)C(C)=O)C(C)=O- InChIKey
BGRWYDHXPHLNKA-UHFFFAOYSA-N- 分子式
- C10H16N2O4
- 平均分子量
- 228.24 g/mol
- 単同位体質量
- 228.11100699
概要
Tetraacetylethylenediamine is a dicarboximide.
名称と識別子
- 優先名称
- Tetraacetylethylenediamine
- IUPAC
- N-acetyl-N-[2-(diacetylamino)ethyl]acetamide
- 現地名
- N,N,N',N'-テトラアセチルエチレンジアミン
- 英語名
- Tetraacetylethylenediamine
- 分子式
- C10H16N2O4
- 分子量
- 228.24
名称と別名
名称をさらに表示
データベース識別子
- CAS
10543-57-4- PubChem CID
- 66347
- DTXSID
DTXSID5040752- ChEBI
CHEBI:166456- UNII
- P411ED0N2B
- EC Number
- 234-123-8
- Nikkaji
- J150.345F
物性
構造計算による物性
- XLogP
- -1.2
- 極性表面積
- 74.8 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 4
- 回転可能結合数
- 3
- 重原子数
- 16
- 形式電荷
- 0
- 複雑度
- 265
実験および物理化学的性質
Physical Description
Large Crystals; Dry Powder; Other Solid
Solid
物理化学的性質
- 融点
- 149 · 149-154 °C
- 沸点
- 140 °C · 140 °C (1.5002 mmHg)
- 比重(密度)
- 0.9 · 0.9
- 屈折率
- 1.455 · 1.4550 (estimate)
- 闪点
- 140 °C · 140 °C
- 酸解離定数(Pka)
- -1.23 · -1.23±0.70(Predicted)
- 外見
- 粒状粉末
- 色
- オフホワイトからベージュ
- 水溶解度
- わずかに溶ける
- Merck
- 14 · 14,9028
- BRN
- 1795711 · 1795711
- 化粧品成分の機能
- 漂白
- InChI
- 1S/C10H16N2O4/c1-7(13)11(8(2)14)5-6-12(9(3)15)10(4)16/h5-6H2,1-4H3
- InChIKey
- BGRWYDHXPHLNKA-UHFFFAOYSA-N
- SMILES
- CC(=O)N(CCN(C(C)=O)C(C)=O)C(C)=O
- CAS データベース
- 10543 · 10543-57-4(CAS DataBase Reference)
- NISTの化学物質情報
- N,n,n',n'-tetraacetylethylenediamine(10543-57-4)
- EPAの化学物質情報
- Tetraacetylethylenediamine (10543-57-4)
化学的性質
化学的特性Tetraacetylethylenediamine is off-white to beige granular powder
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (435 of 435) of all reports.
Not Classified
Aggregated GHS information provided per 435 reports by companies from 1 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: Acetamide, N,N'-1,2-ethanediylbis[N-acetyl-
Acetamide, N,N'-1,2-ethanediylbis[N-acetyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Acetamide, N,N'-1,2-ethanediylbis[N-acetyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 11-04-2014 https://echa.europa.eu/registration-dossier/-/registered-dossier/14315
Tetraacetyl ethylenediamine: Does not have an individual approval but may be used under an appropriate group standard
安全データ
- wgk
- 1
- tsca
- TSCA listed
- hs_code
- 29241900
- 化審法
- 2-3577
- safety_code
- 22-24/25
- ストレージクラス
- 11 - Combustible Solids
化学と産業
薬理情報
用途と製造
Use Classification
EPA Safer Chemical Functional Use Classes -> Oxidants and Oxidant Stabilizers
Safer Chemical Classes -> Yellow triangle - The chemical has met Safer Choice Criteria for its functional ingredient-class, but has some hazard profile issues
Cosmetics -> Bleaching
General Manufacturing Information
Wholesale and Retail Trade
Acetamide, N,N'-1,2-ethanediylbis[N-acetyl-: ACTIVE
応用分野
使用Tetraacetylethylenediamine (TAED) is a bleaching activator which is mainly used in detergents and additives for laundry washing and dishwashing. Typical concentrations of TAED range between 1.4% and 13% in these products. A small amount of the produced TAED is also used in bleaching of paper, textiles and for the generation of Peracetic acid. Peroxide bleach activator for household detergents, paper pulp.
調製方法
製造方法Tetraacetylethylenediamine (TAED) is produced in a two stage process from ethylenediamine (ED) and acetic anhydride (Ac2O). ED is first diacetylated to DAED. In the second step DAED is subsequently converted with Ac2O via TriAED into TAED (Clariant, 1999). TAED is crystallized out of the reaction mixture, filtered, washed and dried, and if necessary also granulated. The raw materials used occur almost quantitatively in the product. Byproducts are not formed. TAED was prepared by acetylation of diacetylethylenediamine (DAED) with acetic anhydride in a 5 L reactor coupled with a packed distillation column, 2.5 cm in inside diameter and 1 m in length. The reaction temperature was set at 135 °C and the reflux ratio at 6. The molar ratio of acetic anhydride to DAED was varied from 3 to 5. A TAED yield as high as 80% was obtained, higher by 15% than in the absence of distillation.
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