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Substance Name: Benzoic acid, 3-(N-methyl-N-phenethylamino)propyl ester, hydrochloride
RN: 67031-85-0
InChIKey: VOYQTGBMRPFQKE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H23-N-O2.Cl-H

Molecular Weight

  • 333.857
 
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Names and Synonyms

  • Benzoic acid, 3-(N-methyl-N-phenethylamino)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 67031-85-0

System Generated Number

  • 0067031850

Molecular Formulas

Molecular Formula

  • C19-H23-N-O2.Cl-H

Molecular Formula Fragments

  • C19-H23-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H23NO2.ClH/c1-20(15-13-17-9-4-2-5-10-17)14-8-16-22-19(21)18-11-6-3-7-12-18;/h2-7,9-12H,8,13-16H2,1H3;1H

InChIKey

VOYQTGBMRPFQKE-UHFFFAOYSA-N

Smiles

c1(C(OCCC[N@@H+](CCc2ccccc2)C)=O)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 1800mg/kg (1800mg/kg)   Journal of the American Chemical Society. Vol. 53, Pg. 1587, 1931.
rat LDLo intravenous 35mg/kg (35mg/kg)   Journal of the American Chemical Society. Vol. 53, Pg. 1587, 1931.