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Substance Name: Phenetole, beta-(N-(2-chloroethyl)-N-methylamino)-2-isopropyl-5-methyl-, hydrochloride
RN: 16793-50-3
InChIKey: RXUBEMUKSKJEDL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H24-Cl-N-O.Cl-H

Molecular Weight

  • 306.275
 
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Names and Synonyms

Synonyms

  • beta-(N-(2-Chloroethyl)-N-methylamino)-2-isopropyl-5-methylphenetole hydrochloride
  • p-Cymene, 3-(2-(N-(2-chloroethyl)-N-methylamino)ethoxy)-, hydrochloride
  • WV 0016

Systematic Name

  • Phenetole, beta-(N-(2-chloroethyl)-N-methylamino)-2-isopropyl-5-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 16793-50-3

System Generated Number

  • 0016793503

Molecular Formulas

Molecular Formula

  • C15-H24-Cl-N-O.Cl-H

Molecular Formula Fragments

  • C15-H24-Cl-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H24ClNO.ClH/c1-12(2)14-6-5-13(3)11-15(14)18-10-9-17(4)8-7-16;/h5-6,11-12H,7-10H2,1-4H3;1H

InChIKey

RXUBEMUKSKJEDL-UHFFFAOYSA-N

Smiles

C[N@@](CCCl)CCOc1cc(C)ccc1C(C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 80mg/kg (80mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 17, Pg. 305, 1967.