Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ammonium, benzyl(2-chloroethyl)ethylmethyl-, methyl sulfate
RN: 66902-69-0
InChIKey: MWKUVOJSLLBIPM-UHFFFAOYSA-M

Molecular Formula

  • C12-H19-Cl-N.C-H3-O4-S

Molecular Weight

  • 323.839
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • Benzyl(2-chloroethyl)ethylmethylammonium methyl sulfate

Systematic Name

  • Ammonium, benzyl(2-chloroethyl)ethylmethyl-, methyl sulfate

Registry Numbers

CAS Registry Number

  • 66902-69-0

System Generated Number

  • 0066902690

Molecular Formulas

Molecular Formula

  • C12-H19-Cl-N.C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C12-H19-Cl-N
  • COMPONENT

Structure Descriptors

InChI

1S/C12H19ClN.CH4O4S/c1-3-14(2,10-9-13)11-12-7-5-4-6-8-12;1-5-6(2,3)4/h4-8H,3,9-11H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1

InChIKey

MWKUVOJSLLBIPM-UHFFFAOYSA-M

Smiles

C([N@@+](CCCl)(CC)C)c1ccccc1.S(OC)(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 65mg/kg (65mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 97, Pg. 25, 1949.