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Substance Name: Benzoic acid, p-amino-, (2-(isopropylamino)-1-methyl)ethyl ester, hydrochloride
RN: 69781-17-5
InChIKey: YAINMCNNAMZKGB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H20-N2-O2.Cl-H

Molecular Weight

  • 272.774
 
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Names and Synonyms

Synonym

  • p-Aminobenzoic acid (2-(isopropylamino)-1-methyl)ethyl ester hydrochloride

Systematic Name

  • Benzoic acid, p-amino-, (2-(isopropylamino)-1-methyl)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 69781-17-5

System Generated Number

  • 0069781175

Molecular Formulas

Molecular Formula

  • C13-H20-N2-O2.Cl-H

Molecular Formula Fragments

  • C13-H20-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H20N2O2.ClH/c1-9(2)15-8-10(3)17-13(16)11-4-6-12(14)7-5-11;/h4-7,9-10,15H,8,14H2,1-3H3;1H

InChIKey

YAINMCNNAMZKGB-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 750mg/kg (750mg/kg)   Journal of the American Chemical Society. Vol. 66, Pg. 1453, 1944.