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Substance Name: Butyric acid, 4-amino-2-(p-chlorophenyl)-, ethyl ester, hydrochloride
RN: 66859-66-3
InChIKey: CUBDJBJBQYDLCJ-UHFFFAOYSA-N

Molecular Formula

  • C12-H16-Cl-N-O2.Cl-H

Molecular Weight

  • 278.177
 
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Names and Synonyms

Synonym

  • Ethyl 4-amino-2-(p-chlorophenyl)butyrate hydrochloride

Systematic Name

  • Butyric acid, 4-amino-2-(p-chlorophenyl)-, ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 66859-66-3

System Generated Number

  • 0066859663

Molecular Formulas

Molecular Formula

  • C12-H16-Cl-N-O2.Cl-H

Molecular Formula Fragments

  • C12-H16-Cl-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H16ClNO2.ClH/c1-2-16-12(15)11(7-8-14)9-3-5-10(13)6-4-9;/h3-6,11H,2,7-8,14H2,1H3;1H

InChIKey

CUBDJBJBQYDLCJ-UHFFFAOYSA-N

Smiles

c1([C@@H](C(OCC)=O)CC[NH3+])ccc(Cl)cc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 160mg/kg (160mg/kg)   Journal of Medicinal Chemistry. Vol. 6, Pg. 539, 1963.