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Substance Name: Pyrrolidineacetic acid, 2,6-xylyl ester, hydrochloride
RN: 2020-28-2
InChIKey: HOHYOBBELNRSEV-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Skin / Eye Irritant

Molecular Formula

  • C14-H19-N-O2.Cl-H

Molecular Weight

  • 269.77
 
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Names and Synonyms

Synonyms

  • 2,6-Xylyl pyrrolidineacetate hydrochloride
  • C 3220
  • FC-425

Systematic Name

  • Pyrrolidineacetic acid, 2,6-xylyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 2020-28-2

System Generated Number

  • 0002020282

Molecular Formulas

Molecular Formula

  • C14-H19-N-O2.Cl-H

Molecular Formula Fragments

  • C14-H19-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H19NO2.ClH/c1-11-6-5-7-12(2)14(11)17-13(16)10-15-8-3-4-9-15;/h5-7H,3-4,8-10H2,1-2H3;1H

InChIKey

HOHYOBBELNRSEV-UHFFFAOYSA-N

Smiles

c1ccc(c(c1C)OC(CN1CCCC1)=O)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 525mg/kg (525mg/kg)   Bollettino Chimico Farmaceutico. Vol. 107, Pg. 310, 1968.
rat LD50 intraperitoneal 380mg/kg (380mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 8, Pg. 708, 1958.