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Substance Name: Ammonium, octadecyltrimethyl-, p-chlorophenylsulfonate
RN: 73636-94-9
InChIKey: ZZVAPXSOGZAXIX-UHFFFAOYSA-M

Molecular Formula

  • C21-H46-N.C6-H4-Cl-O3-S

Molecular Weight

  • 504.215
 
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Names and Synonyms

Synonyms

  • Ammonium, (octadecyl)trimethyl-, p-chlorophenylsulfonate
  • NSC 74569
  • Octadecyltrimethylammonium p-chlorosulfonate

Systematic Name

  • Ammonium, octadecyltrimethyl-, p-chlorophenylsulfonate

Registry Numbers

CAS Registry Number

  • 73636-94-9

System Generated Number

  • 0073636949

Molecular Formulas

Molecular Formula

  • C21-H46-N.C6-H4-Cl-O3-S

Molecular Formula Fragments

  • C21-H46-N
  • C6-H4-Cl-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C21H46N.C6H5ClO3S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(2,3)4;7-5-1-3-6(4-2-5)11(8,9)10/h5-21H2,1-4H3;1-4H,(H,8,9,10)/q+1;/p-1

InChIKey

ZZVAPXSOGZAXIX-UHFFFAOYSA-M

Smiles

c1(ccc(Cl)cc1)S(=O)(=O)[O-].C(CCCCCCCCCCCCCCC)CC[N+](C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#05615,