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Substance Name: Benzoic acid, p-butoxy-, 3-(2-methylpiperidino)propyl ester, hydrochloride
RN: 67032-45-5
InChIKey: JWLQUBHYSIQFTM-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Skin / Eye Irritant

Molecular Formula

  • C20-H31-N-O3.Cl-H

Molecular Weight

  • 369.93
 
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Names and Synonyms

Synonyms

  • C-10
  • p-Butoxybenzoic acid 3-(2-methylpiperidino)propyl ester hydrochloride

Systematic Name

  • Benzoic acid, p-butoxy-, 3-(2-methylpiperidino)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 67032-45-5

System Generated Number

  • 0067032455

Molecular Formulas

Molecular Formula

  • C20-H31-N-O3.Cl-H

Molecular Formula Fragments

  • C20-H31-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H31NO3.ClH/c1-3-4-15-23-19-11-9-18(10-12-19)20(22)24-16-7-14-21-13-6-5-8-17(21)2;/h9-12,17H,3-8,13-16H2,1-2H3;1H

InChIKey

JWLQUBHYSIQFTM-UHFFFAOYSA-N

Smiles

c1(ccc(OCCCC)cc1)C(OCCC[N@@H+]1[C@@H](CCCC1)C)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 73600ug/kg (73.6mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 137, Pg. 410, 1962.
mouse LD50 intravenous 22mg/kg (22mg/kg)   Journal of the American Chemical Society. Vol. 68, Pg. 2592, 1946.
mouse LD50 subcutaneous 177mg/kg (177mg/kg)   Journal of the American Chemical Society. Vol. 68, Pg. 2592, 1946.