Product Name

  • Name

    DDAO

  • EINECS 220-020-5
  • CAS No. 2605-79-0
  • Article Data6
  • CAS DataBase
  • Density 0.996 g/mL at 20 °C
  • Solubility 409.5g/L at 30℃
  • Melting Point
  • Formula C12H27NO
  • Boiling Point
  • Molecular Weight 201.352
  • Flash Point
  • Transport Information
  • Appearance liquid
  • Safety 26-24/25
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 2605-79-0 (DDAO)
  • Hazard Symbols IrritantXi
  • Synonyms Decylamine,N,N-dimethyl-, N-oxide (7CI,8CI);Ammonyx C 10;Ammonyx DO;Ammonyx DO-C 10;Aromox DM 10DW;Barlox 10S;Decyl-N,N-dimethylamine oxide;DecyldimethylamineN-oxide;Decyldimethylamine oxide;Dimethyl decylamine oxide;Genaminox DC 40;Genaminox K 10;Mackamine 065;N,N-Dimethyl-1-decanamine oxide;N,N-Dimethyl-n-decylamine oxide;N-Decyl-N,N-dimethylamine oxide;Tegotens DO;
  • PSA 29.43000
  • LogP 3.72220

Synthetic route

N,N-dimethyldecylamine
1120-24-7

N,N-dimethyldecylamine

N,N-dimethyldecylamine-N-oxide
2605-79-0

N,N-dimethyldecylamine-N-oxide

Conditions
ConditionsYield
With dihydrogen peroxide; benzonitrile; Mg-Al-O-t-Bu HT (Catalyst B) In methanol; water at 65℃; for 0.5h; Product distribution / selectivity;98%
With dihydrogen peroxide; layered double hydroxide WO4(2-) at 20℃; for 2.5h;97%
With dihydrogen peroxide In methanol; water75%
With 1-decyl-4-(trifluoromethyl)pyrimidinium triflate; dihydrogen peroxide In aq. phosphate buffer; chloroform at 25℃; for 24h; Green chemistry; chemoselective reaction;67%
N,N-dimethyldecylamine-N-oxide
2605-79-0

N,N-dimethyldecylamine-N-oxide

C12H27NO*I2
104586-03-0

C12H27NO*I2

Conditions
ConditionsYield
With iodine In dichloromethane at 20℃; Thermodynamic data; -ΔG0;
With iodine In dichloromethane

Capric dimethyl amine oxide Specification

This chemical is called Capric dimethyl amine oxide, and its CAS registry number is 2605-79-0. With the molecular formula of C12H27NO, its molecular weight is 201.35.Additionally, it should be stored at the temperature of 2-8 °C.

Other characteristics of the Capric dimethyl amine oxide can be summarised as followings: (1)ACD/LogP: 2.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.13; (4)ACD/LogD (pH 7.4): 2.21; (5)ACD/BCF (pH 5.5): 23.5; (6)ACD/BCF (pH 7.4): 28.06; (7)ACD/KOC (pH 5.5): 316.9; (8)ACD/KOC (pH 7.4): 378.31; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 17.07 Å2.

Production method of this chemical: The Capric dimethyl amine oxide could be obtained by the reactant of decyl-dimethyl-amine. This reaction needs the reagent of H2O2, and the solvents of H2O,  methanol. The yield is 75 %.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: [O-][N+](CCCCCCCCCC)(C)C
2.InChI: InChI=1/C12H27NO/c1-4-5-6-7-8-9-10-11-12-13(2,3)14/h4-12H2,1-3H3
3.InChIKey: ZRKZFNZPJKEWPC-UHFFFAOYAU

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