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Substance Name: Benzoic acid, p-amino-, 2-(isopropylamino)butyl ester, hydrochloride
RN: 69781-22-2
InChIKey: KEZYGOIGXNOIOU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H22-N2-O2.Cl-H

Molecular Weight

  • 286.801
 
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Names and Synonyms

Synonym

  • p-Aminobenzoic acid 2-(isopropylamino)butyl ester hydrochloride

Systematic Name

  • Benzoic acid, p-amino-, 2-(isopropylamino)butyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 69781-22-2

System Generated Number

  • 0069781222

Molecular Formulas

Molecular Formula

  • C14-H22-N2-O2.Cl-H

Molecular Formula Fragments

  • C14-H22-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H22N2O2.ClH/c1-4-13(16-10(2)3)9-18-14(17)11-5-7-12(15)8-6-11;/h5-8,10,13,16H,4,9,15H2,1-3H3;1H

InChIKey

KEZYGOIGXNOIOU-UHFFFAOYSA-N

Smiles

c1(C(OC[C@@H]([NH2+]C(C)C)CC)=O)ccc(N)cc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 700mg/kg (700mg/kg)   Journal of the American Chemical Society. Vol. 66, Pg. 1738, 1944.