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Substance Name: Alaproclate hydrochloride, (R)-
RN: 66171-52-6
UNII: XJ50203OAO
InChIKey: OPAKSOWFKIUFNP-SBSPUUFOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H18-Cl-N-O2.Cl-H

Molecular Weight

  • 292.2041
 
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Names and Synonyms

Name of Substance

  • Alaproclate hydrochloride, (R)-

Synonyms

  • (+)-2-(4-Chlorophenyl)-1,1-dimethylethyl 2-aminopropanoate hydrochloride
  • UNII-XJ50203OAO

Systematic Name

  • D-Alanine, 2-(4-chlorophenyl)-1,1-dimethylethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 66171-52-6

FDA UNII

  • XJ50203OAO

System Generated Number

  • 0066171526

Molecular Formulas

Molecular Formula

  • C13-H18-Cl-N-O2.Cl-H

Molecular Formula Fragments

  • C13-H18-Cl-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H18ClNO2.ClH/c1-9(15)12(16)17-13(2,3)8-10-4-6-11(14)7-5-10;/h4-7,9H,8,15H2,1-3H3;1H/t9-;/m1./s1

InChIKey

OPAKSOWFKIUFNP-SBSPUUFOSA-N

Smiles

Cl.C[C@@H](N)C(=O)OC(C)(C)Cc1ccc(Cl)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 448, 1978.
mouse LD50 intravenous 60mg/kg (60mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 448, 1978.