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Substance Name: Propanoic acid, 2-methyl-2-(4-((trifluoromethyl)sulfonyl)phenoxy)-, ethyl ester
RN: 26133-20-0
InChIKey: SOEMGZMZNINGPN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H15-F3-O5-S

Molecular Weight

  • 340.316
 
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Names and Synonyms

Synonyms

  • Ethyl 2-methyl-2-(4-((trifluoromethyl)sulfonyl)phenoxy)propanoate
  • Ethyl p-trifluoromethylsulfonylphenoxyisobutyrate

Systematic Name

  • Propanoic acid, 2-methyl-2-(4-((trifluoromethyl)sulfonyl)phenoxy)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 26133-20-0

System Generated Number

  • 0026133200

Structure Descriptors

InChI

1S/C13H15F3O5S/c1-4-20-11(17)12(2,3)21-9-5-7-10(8-6-9)22(18,19)13(14,15)16/h5-8H,4H2,1-3H3

InChIKey

SOEMGZMZNINGPN-UHFFFAOYSA-N

Smiles

C(C(C)(Oc1ccc(cc1)S(=O)(=O)C(F)(F)F)C)(=O)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD unreported > 320mg/kg (320mg/kg)   United States Patent Document. Vol. #3860721,