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Substance Name: 1H-Benzimidazolium, 1,2-dimethyl-3-(3-sulfopropyl)-5-(trifluoromethyl)-, chloride, sodium salt (1:1:1)
RN: 68413-90-1
InChIKey: HVLXYARDVORZRK-UHFFFAOYSA-M

Molecular Formula

  • C13-H16-F3-N2-O3-S.Cl.Na

Molecular Weight

  • 394.776
 
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Names and Synonyms

Synonyms

  • 1,2-Methyl-5-(trifluoromethyl)-3-(3-sulfopropyl)benzimidazolium chloride, sodium salt
  • EINECS 270-262-0

Systematic Names

  • 1,2-Dimethyl-3-(3-sulphonatopropyl)-5-(trifluoromethyl)-1H-benzimidazolium sodium chloride
  • 1H-Benzimidazolium, 1,2-dimethyl-3-(3-sulfopropyl)-5-(trifluoromethyl)-, chloride, sodium salt
  • 1H-Benzimidazolium, 1,2-dimethyl-3-(3-sulfopropyl)-5-(trifluoromethyl)-, chloride, sodium salt (1:1:1)

Registry Numbers

CAS Registry Number

  • 68413-90-1

System Generated Number

  • 0068413901

Molecular Formulas

Molecular Formula

  • C13-H16-F3-N2-O3-S.Cl.Na

Molecular Formula Fragments

  • C13-H16-F3-N2-O3-S
  • Cl
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C13H15F3N2O3S.ClH.Na/c1-9-17(2)11-5-4-10(13(14,15)16)8-12(11)18(9)6-3-7-22(19,20)21;;/h4-5,8H,3,6-7H2,1-2H3;1H;/q;;+1/p-1

InChIKey

HVLXYARDVORZRK-UHFFFAOYSA-M

Smiles

[n+]1(c(n(C)c2c1cc(C(F)(F)F)cc2)C)CCCS(=O)(=O)[O-].[ClH-].[Na+]