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Substance Name: Benzoic acid, p-(octyloxy)-, 2-diethylaminoethyl ester, hydrochloride
RN: 14245-83-1
InChIKey: KRIYQKRFBPPLIS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H35-N-O3.Cl-H

Molecular Weight

  • 385.972
 
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Names and Synonyms

Synonym

  • p-(Octyloxy)benzoic acid 2-diethylaminoethyl ester hydrochloride

Systematic Name

  • Benzoic acid, p-(octyloxy)-, 2-diethylaminoethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 14245-83-1

System Generated Number

  • 0014245831

Molecular Formulas

Molecular Formula

  • C21-H35-N-O3.Cl-H

Molecular Formula Fragments

  • C21-H35-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H35NO3.ClH/c1-4-7-8-9-10-11-17-24-20-14-12-19(13-15-20)21(23)25-18-16-22(5-2)6-3;/h12-15H,4-11,16-18H2,1-3H3;1H

InChIKey

KRIYQKRFBPPLIS-UHFFFAOYSA-N

Smiles

c1(ccc(OCCCCCCCC)cc1)C(OCC[NH+](CC)CC)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 175mg/kg (175mg/kg)   Journal of Pharmacy and Pharmacology. Vol. 6, Pg. 119, 1954.