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Substance Name: 1-Propanone, 3-(dibutylamino)-1-(3-ethyl-4-methoxyphenyl)-, hydrochloride (9CI)
RN: 52100-92-2
InChIKey: JVMSNZHUUDNMQY-UHFFFAOYSA-N

Molecular Formula

  • C20-H33-N-O2.Cl-H

Molecular Weight

  • 355.9466
 
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Names and Synonyms

Synonyms

  • 3-Dibutylamino-3'-ethyl-4'-methoxy-propiophenone hydrochloride
  • beta-Di-n-butylaminoaethyl-(4-methoxy-3-aethylphenyl)-ketonhydrocholorid
  • beta-Di-n-butylaminoaethyl-(4-methoxy-3-aethylphenyl)-ketonhydrocholorid [German]

Systematic Names

  • 1-Propanone, 3-(dibutylamino)-1-(3-ethyl-4-methoxyphenyl)-, hydrochloride (9CI)
  • Propiophenone, 3-dibutylamino-3'-ethyl-4'-methoxy-, hydrochloride

Registry Numbers

CAS Registry Number

  • 52100-92-2

System Generated Number

  • 0052100922

Molecular Formulas

Molecular Formula

  • C20-H33-N-O2.Cl-H

Molecular Formula Fragments

  • C20-H33-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H33NO2.ClH/c1-5-8-13-21(14-9-6-2)15-12-19(22)18-10-11-20(23-4)17(7-3)16-18;/h10-11,16H,5-9,12-15H2,1-4H3;1H

InChIKey

JVMSNZHUUDNMQY-UHFFFAOYSA-N

Smiles

CCCCN(CCCC)CCC(=O)c1ccc(c(c1)CC)OC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 760mg/kg (760mg/kg)   Pharmazie. Vol. 28, Pg. 636, 1973.