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Substance Name: Sulfonium, (beta-phenoxyethyl)dimethyl-, nitrate
RN: 64037-03-2
InChIKey: HOUHCULPUAMVJW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H15-O-S.N-O3

Molecular Weight

  • 245.298
 
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Names and Synonyms

Synonyms

  • beta-Phenoxyethyl-dimethylsulfonium nitrate
  • Dimethyl(2-phenoxyethyl)sulfonium nitrate
  • Sulfonium, dimethyl(2-phenoxyethyl)-, nitrate

Systematic Name

  • Sulfonium, (beta-phenoxyethyl)dimethyl-, nitrate

Registry Numbers

CAS Registry Number

  • 64037-03-2

System Generated Number

  • 0064037032

Molecular Formulas

Molecular Formula

  • C10-H15-O-S.N-O3

Molecular Formula Fragments

  • C10-H15-O-S
  • COMPONENT
  • N-O3

Structure Descriptors

InChI

1S/C10H15OS.NO3/c1-12(2)9-8-11-10-6-4-3-5-7-10;2-1(3)4/h3-7H,8-9H2,1-2H3;/q+1;-1

InChIKey

HOUHCULPUAMVJW-UHFFFAOYSA-N

Smiles

[S+](CCOc1ccccc1)(C)C.O=N(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 280mg/kg (280mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 44, Pg. 63, 1932.