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Substance Name: Phenethylamine, N,N-dimethyl-beta-prop-2-ynyl-
RN: 33132-81-9
InChIKey: PTIIMCBYLBHDSE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H17-N

Molecular Weight

  • 187.284
 
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Names and Synonyms

Synonyms

  • BRN 2093998
  • N,N-Dimethyl-beta-prop-2-ynyl phenethylamine

Systematic Name

  • Phenethylamine, N,N-dimethyl-beta-prop-2-ynyl-

Registry Numbers

CAS Registry Number

  • 33132-81-9

System Generated Number

  • 0033132819

Structure Descriptors

InChI

1S/C13H17N/c1-4-8-13(11-14(2)3)12-9-6-5-7-10-12/h1,5-7,9-10,13H,8,11H2,2-3H3

InChIKey

PTIIMCBYLBHDSE-UHFFFAOYSA-N

Smiles

c1(ccccc1)[C@@H](CN(C)C)CC#C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 42mg/kg (42mg/kg)   Chimica Therapeutica. Vol. 6, Pg. 453, 1971.
mouse LD50 oral 388mg/kg (388mg/kg)   Chimica Therapeutica. Vol. 6, Pg. 453, 1971.