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Substance Name: Benzoic acid, 2-(cyclopentylamino)propyl ester, hydrochloride
RN: 67032-26-2
InChIKey: QYNKHKRIWBDESU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H21-N-O2.Cl-H

Molecular Weight

  • 283.797
 
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Names and Synonyms

  • Benzoic acid, 2-(cyclopentylamino)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 67032-26-2

System Generated Number

  • 0067032262

Molecular Formulas

Molecular Formula

  • C15-H21-N-O2.Cl-H

Molecular Formula Fragments

  • C15-H21-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H21NO2.ClH/c1-12(16-14-9-5-6-10-14)11-18-15(17)13-7-3-2-4-8-13;/h2-4,7-8,12,14,16H,5-6,9-11H2,1H3;1H

InChIKey

QYNKHKRIWBDESU-UHFFFAOYSA-N

Smiles

c1(C(OC[C@@H]([NH2+]C2CCCC2)C)=O)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 50mg/kg (50mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 90, Pg. 181, 1947.
mouse LD50 subcutaneous > 1gm/kg (1000mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 90, Pg. 181, 1947.