Product Name

  • Name

    LAPAO

  • EINECS 263-218-7
  • CAS No. 61792-31-2
  • Article Data2
  • CAS DataBase
  • Density 1.06g/cm3 at 20℃
  • Solubility
  • Melting Point 119-122 °C
  • Formula C17H36N2O2
  • Boiling Point
  • Molecular Weight 300.485
  • Flash Point >100℃
  • Transport Information
  • Appearance
  • Safety 26-39
  • Risk Codes 22-38-41
  • Molecular Structure Molecular Structure of 61792-31-2 (LAPAO)
  • Hazard Symbols Xn
  • Synonyms Dodecanamide,N-[3-(dimethylamino)propyl]-, N-oxide;3-Lauramido-N,N-dimethylpropylamineoxide;3-Lauramidopropyl-N,N-dimethylamine oxide;Dodecylamidopropyldimethylamine oxide;LAPAO;Laurylamidopropyldimethylamineoxide;Mackamine LAO;N,N-Dimethylaminopropyldodecylamide oxide;N-(Dodecylamidetrimethylene)dimethylamine oxide;N-Lauroylaminopropyl-N,N-dimethylamine oxide;Softazoline LAO;SoftazolineLAO-C;
  • PSA 58.53000
  • LogP 4.39960

Synthetic route

lauric acid dimethylaminopropylamide
3179-80-4

lauric acid dimethylaminopropylamide

dimethyldodecylamidopropylamine oxide
61792-31-2

dimethyldodecylamidopropylamine oxide

Conditions
ConditionsYield
With dihydrogen peroxide In water at 75 - 85℃; for 7h; Product distribution / selectivity;

Laurylamidopropyldimethylamine oxide Specification

The Dodecanamide, N-[3-(dimethyloxidoamino)propyl]-, with the CAS registry number of 61792-31-2, is also known as N-[3-(Dimethylamino)propyl]dodecanamide N-oxide and N-[3-(Dimethyloxidoamino)propyl]-dodecanamide. Its EINECS registry number is 263-218-7. This chemical's molecular formula is C17H36N2O2 and molecular weight is 300.47994. What's more, its IUPAC name is 3-(Dodecanoylamino)-N, N-dimethylpropan-1-amine oxide.

Physical properties about Dodecanamide, N-[3-(dimethyloxidoamino)propyl]- are: (1)ACD/LogP: 2.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.94; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 17.12; (6)ACD/BCF (pH 7.4): 19.43; (7)ACD/KOC (pH 5.5): 256.34; (8)ACD/KOC (pH 7.4): 290.89; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 14; (12)Polar Surface Area: 37.38 Å2; (13)Melting Point: 119-122 ºC.

You can still convert the following datas into molecular structure:
(1) SMILES: [O-][N+](C)(CCCNC(=O)CCCCCCCCCCC)C
(2) InChI: InChI=1/C17H36N2O2/c1-4-5-6-7-8-9-10-11-12-14-17(20)18-15-13-16-19(2,3)21/h4-16H2,1-3H3,(H,18,20)
(3) InChIKey: JNGWKQJZIUZUPR-UHFFFAOYAE

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