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Substance Name: Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride
RN: 67465-32-1
InChIKey: NDIXNZOYIHXERB-UHFFFAOYSA-N

Molecular Formula

  • C16-H23-N-O5.Cl-H

Molecular Weight

  • 345.821
 
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Names and Synonyms

Synonym

  • Diethyl 2-aminoethyl-(p-methoxyphenyl)malonate hydrochloride

Systematic Name

  • Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 67465-32-1

System Generated Number

  • 0067465321

Molecular Formulas

Molecular Formula

  • C16-H23-N-O5.Cl-H

Molecular Formula Fragments

  • C16-H23-N-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H23NO5.ClH/c1-4-21-14(18)16(10-11-17,15(19)22-5-2)12-6-8-13(20-3)9-7-12;/h6-9H,4-5,10-11,17H2,1-3H3;1H

InChIKey

NDIXNZOYIHXERB-UHFFFAOYSA-N

Smiles

C(c1ccc(OC)cc1)(C(OCC)=O)(C(OCC)=O)CC[NH3+].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 260mg/kg (260mg/kg)   Journal of Medicinal Chemistry. Vol. 6, Pg. 539, 1963.