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Substance Name: 1,3-Propanediaminium, N1,N1,N1,N3,N3-pentamethyl-N3-(9Z)-9-octadecen-1-yl-, chloride (1:2)
RN: 68310-73-6
InChIKey: XERDYBRCVFVRCH-GEKVWEGFSA-L

Molecular Formula

  • C26-H56-N2.2Cl

Molecular Weight

  • 467.648
 
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Names and Synonyms

Synonyms

  • (Z)-9-Octadecenyl-1,3-propylenediammonium chloride
  • EINECS 269-730-7

Systematic Names

  • (Z)-N,N,N,N',N'-Pentamethyl-N'-octadec-9-enyl-N,N'-propane-1,3-diyldiammonium dichloride
  • 1,3-Propanediaminium, N,N,N,N',N'-pentamethyl-N'-(9Z)-9-octadecenyl-, dichloride
  • 1,3-Propanediaminium, N1,N1,N1,N3,N3-pentamethyl-N3-(9Z)-9-octadecen-1-yl-, chloride (1:2)

Registry Numbers

CAS Registry Number

  • 68310-73-6

System Generated Number

  • 0068310736

Molecular Formulas

Molecular Formula

  • C26-H56-N2.2Cl

Molecular Formula Fragments

  • C26-H56-N2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C26H56N2.2ClH/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-28(5,6)26-23-24-27(2,3)4;;/h14-15H,7-13,16-26H2,1-6H3;2*1H/q+2;;/p-2/b15-14-;;

InChIKey

XERDYBRCVFVRCH-GEKVWEGFSA-L

Smiles

CCCCCCCC\C=C/CCCCCCCC[N+](C)(C)CCC[N+](C)(C)C.[ClH-].[ClH-]