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Substance Name: Ethanol, 2-(alpha-methyl-m-trifluoromethylphenethylamino)-, 2-methyl-2-butenoate
RN: 73927-43-2
InChIKey: KAZCKTIWXCULAH-UUILKARUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H22-F3-N-O2

Molecular Weight

  • 329.36
 
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Names and Synonyms

Synonyms

  • 2-(alpha-Methyl-m-trifluoromethylphenethylamino)ethanol 3-methyl-2-butenoate
  • BRN 2998393
  • N-(2-Hydroxyethyl)-alpha-methyl-m-trifluoromethylphenethylamine 3-methyl-2-butenoate
  • Phenethylamine, N-(2-hydroxyethyl)-alpha-methyl-m-trifluoromethyl-, 3-methyl-2-butenoate

Systematic Name

  • Ethanol, 2-(alpha-methyl-m-trifluoromethylphenethylamino)-, 2-methyl-2-butenoate

Registry Numbers

CAS Registry Number

  • 73927-43-2

System Generated Number

  • 0073927432

Structure Descriptors

InChI

1S/C17H22F3NO2/c1-4-12(2)16(22)23-9-8-21-13(3)10-14-6-5-7-15(11-14)17(18,19)20/h4-7,11,13,21H,8-10H2,1-3H3/b12-4+

InChIKey

KAZCKTIWXCULAH-UUILKARUSA-N

Smiles

c1(cc(ccc1)C(F)(F)F)C[C@@H](NCCOC(\C(=C\C)C)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 155mg/kg (155mg/kg)   "International Symposium on Amphetamines and Related Compounds, Proceedings, Mario Negri Institute for Pharmacological Research, Milan, 1969," Costa, E., and S. Garattini, eds., New York, Raven Press, 1970Vol. -, Pg. 21, 1970.