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Substance Name: Ethanaminium, 2-(2-(1-oxopropoxy)-1-oxopropoxy)-N,N,N-trimethyl-, 1,5- naphthalenedisulfonate (2:1)
RN: 55077-37-7
InChIKey: LIXVVPZNOJGBHQ-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H44-N2-O8.C10-H6-O6-S2

Molecular Weight

  • 750.879
 
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Names and Synonyms

  • Ethanaminium, 2-(2-(1-oxopropoxy)-1-oxopropoxy)-N,N,N-trimethyl-, 1,5- naphthalenedisulfonate (2:1)

Registry Numbers

CAS Registry Number

  • 55077-37-7

System Generated Number

  • 0055077377

Molecular Formulas

Molecular Formula

  • C22-H44-N2-O8.C10-H6-O6-S2

Molecular Formula Fragments

  • C10-H6-O6-S2
  • C22-H44-N2-O8
  • COMPONENT

Structure Descriptors

InChI

1S/2C11H22NO4.C10H8O6S2/c2*1-6-10(13)16-9(2)11(14)15-8-7-12(3,4)5;11-17(12,13)9-5-1-3-7-8(9)4-2-6-10(7)18(14,15)16/h2*9H,6-8H2,1-5H3;1-6H,(H,11,12,13)(H,14,15,16)/q2*+1;/p-2

InChIKey

LIXVVPZNOJGBHQ-UHFFFAOYSA-L

Smiles

CCC(=O)OC(C)C(=O)OCC[N+](C)(C)C.CCC(=O)OC(C)C(=O)OCC[N+](C)(C)C.c1cc2c(cccc2S(=O)(=O)[O-])c(c1)S(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 400mg/kg (400mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 99, Pg. 1245, 1979.