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Substance Name: Butyric acid, 4-amino-2-phenyl-, ethyl ester, hydrochloride
RN: 66859-47-0
InChIKey: ZXEMVKXLQWXELP-UHFFFAOYSA-N

Molecular Formula

  • C12-H17-N-O2.Cl-H

Molecular Weight

  • 243.732
 
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Names and Synonyms

Synonym

  • Ethyl(4-amino-2-phenyl)butyrate hydrochloride

Systematic Name

  • Butyric acid, 4-amino-2-phenyl-, ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 66859-47-0

System Generated Number

  • 0066859470

Molecular Formulas

Molecular Formula

  • C12-H17-N-O2.Cl-H

Molecular Formula Fragments

  • C12-H17-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H17NO2.ClH/c1-2-15-12(14)11(8-9-13)10-6-4-3-5-7-10;/h3-7,11H,2,8-9,13H2,1H3;1H

InChIKey

ZXEMVKXLQWXELP-UHFFFAOYSA-N

Smiles

c1([C@@H](C(OCC)=O)CC[NH3+])ccccc1.[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.