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Substance Name: Alanine, 3-benzoyl-N-(2-hydroxyethyl)-, ethyl ester, hydrochloride
RN: 15121-90-1
InChIKey: FHCVDWKCUIDJLP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H19-N-O4.Cl-H

Molecular Weight

  • 301.768
 
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Names and Synonyms

Synonyms

  • 3-Benzoyl-N-(2-hydroxyethyl)alanine ethyl ester hydrochloride
  • alpha-(2-Oxyethylamino)-beta-benzoylpropionic acid ethyl ester hydrochloride

Systematic Name

  • Alanine, 3-benzoyl-N-(2-hydroxyethyl)-, ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 15121-90-1

System Generated Number

  • 0015121901

Molecular Formulas

Molecular Formula

  • C14-H19-N-O4.Cl-H

Molecular Formula Fragments

  • C14-H19-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H19NO4.ClH/c1-2-19-14(18)12(15-8-9-16)10-13(17)11-6-4-3-5-7-11;/h3-7,12,15-16H,2,8-10H2,1H3;1H

InChIKey

FHCVDWKCUIDJLP-UHFFFAOYSA-N

Smiles

C([C@@H](C(OCC)=O)[NH2+]CCO)C(c1ccccc1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 8gm/kg (8000mg/kg)   Shokuhin Eiseigaku Zasshi. Food Hygiene Journal. Vol. 10, Pg. 299, 1969.