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Substance Name: Glycidic acid, 2-(3-(alpha,alpha,alpha-trifluoro-m-tolyl)propyl)-, ethyl ester
RN: 78573-41-8
InChIKey: SDIZRKMLTFYCJA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H17-F3-O3

Molecular Weight

  • 302.29
 
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Names and Synonyms

Synonyms

  • 2-(3-(alpha,alpha,alpha-Trifluoro-m-tolyl)propyl)glycidic acid ethyl ester
  • Ethyl 2-(3-(alpha,alpha,alpha-trifluoro-m-tolyl)propyl)oxirane-2-carboxylate
  • Oxirane-2-carboxylic acid, 2-(3-(m-trifluoromethyl)phenylpropyl)-, ethyl ester

Systematic Name

  • Glycidic acid, 2-(3-(alpha,alpha,alpha-trifluoro-m-tolyl)propyl)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 78573-41-8

System Generated Number

  • 0078573418

Structure Descriptors

InChI

1S/C15H17F3O3/c1-2-20-13(19)14(10-21-14)8-4-6-11-5-3-7-12(9-11)15(16,17)18/h3,5,7,9H,2,4,6,8,10H2,1H3

InChIKey

SDIZRKMLTFYCJA-UHFFFAOYSA-N

Smiles

C1[C@@](O1)(CCCc1cc(ccc1)C(F)(F)F)C(OCC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 260mg/kg (260mg/kg)   Journal of Medicinal Chemistry. Vol. 25, Pg. 109, 1982.