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Substance Name: Phenetole, beta-(N-(2-chloroethyl)-N-ethylamino)-2-isopropyl-4-methoxy-5-methyl-, hydrochloride
RN: 16793-56-9
InChIKey: CVJBDSPTMURGNW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H28-Cl-N-O2.Cl-H

Molecular Weight

  • 350.327
 
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Names and Synonyms

Synonyms

  • beta-(N-(2-Chloroethyl)-N-ethylamino)-2-isopropyl-4-methoxy-5-methylphenetole hydrochloride
  • p-Cymene, 5-(2-(N-(2-chloroethyl)-N-ethylamino)ethoxy)-2-methoxy-, hydrochloride
  • WV 0035

Systematic Name

  • Phenetole, beta-(N-(2-chloroethyl)-N-ethylamino)-2-isopropyl-4-methoxy-5-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 16793-56-9

System Generated Number

  • 0016793569

Molecular Formulas

Molecular Formula

  • C17-H28-Cl-N-O2.Cl-H

Molecular Formula Fragments

  • C17-H28-Cl-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H28ClNO2.ClH/c1-6-19(8-7-18)9-10-21-17-11-14(4)16(20-5)12-15(17)13(2)3;/h11-13H,6-10H2,1-5H3;1H

InChIKey

CVJBDSPTMURGNW-UHFFFAOYSA-N

Smiles

C(CCl)[N@@](CCOc1cc(C)c(cc1C(C)C)OC)CC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 55mg/kg (55mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 17, Pg. 305, 1967.