DOTAP methyl sulfate

CAS Registry Number®

144189-73-1

CAS Name

DOTAP methyl sulfate

Molecular Formula

C42H80NO4.CH3O4S

Cite this Page

DOTAP methyl sulfate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=144189-73-1 (retrieved 2024-11-28) (CAS RN: 144189-73-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Density (1)

    1.11 g/cm³

Source(s)

Other Names and Identifiers

InChI

InChI=1/C42H80NO4.CH4O4S/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-41(44)46-39-40(38-43(3,4)5)47-42(45)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2;1-5-6(2,3)4/h20-23,40H,6-19,24-39H2,1-5H3;1H3,(H,2,3,4)/q+1;/p-1/b22-20-,23-21-;

InChIKey

InChIKey=RSMRWWHFJMENJH-LQDDAWAPNA-M

SMILES

C(OC(CCCCCCC/C=C\CCCCCCCC)=O)(COC(CCCCCCC/C=C\CCCCCCCC)=O)C[N+](C)(C)C.S(OC)(=O)(=O)[O-]

Canonical SMILES

O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)C[N+](C)(C)C)CCCCCCCC=CCCCCCCCC.O=S(=O)([O-])OC

Other Names for this Substance

  • 1-Propanaminium, N,N,N-trimethyl-2,3-bis[[(9Z)-1-oxo-9-octadecen-1-yl]oxy]-, methyl sulfate (1:1)
  • 1-Propanaminium, N,N,N-trimethyl-2,3-bis[(1-oxo-9-octadecenyl)oxy]-, (Z,Z)-, methyl sulfate
  • 1-Propanaminium, N,N,N-trimethyl-2,3-bis[[(9Z)-1-oxo-9-octadecenyl]oxy]-, methyl sulfate
  • DOTAP methyl sulfate
  • DOTAP Me sulfate

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