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Substance Name: 1-Aziridineacetic acid, alpha-(2-(4-chlorophenyl)-2-oxoethyl)-, sodium salt
RN: 108260-22-6
InChIKey: UWYOUACJWVUOHN-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H11-Cl-N-O3.Na.2H2-O

Molecular Weight

  • 275.6659
 
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Names and Synonyms

Synonyms

  • alpha-(2-(4-Chlorophenyl)-2-oxoethyl)-1-aziridineacetic acid sodium salt
  • alpha-Aziridinyl-beta-(p-chlorobenzoyl)propionic acid sodium salt

Systematic Name

  • 1-Aziridineacetic acid, alpha-(2-(4-chlorophenyl)-2-oxoethyl)-, sodium salt

Registry Numbers

CAS Registry Number

  • 108260-22-6

System Generated Number

  • 0108260226

Molecular Formulas

Molecular Formula

  • C12-H11-Cl-N-O3.Na.2H2-O

Molecular Formula Fragments

  • C12-H11-Cl-N-O3
  • COMPONENT
  • H2-O
  • Na

Structure Descriptors

InChI

1S/C12H12ClNO3.Na/c13-9-3-1-8(2-4-9)11(15)7-10(12(16)17)14-5-6-14;/h1-4,10H,5-7H2,(H,16,17);/q;+1/p-1

InChIKey

UWYOUACJWVUOHN-UHFFFAOYSA-M

Smiles

c1cc(ccc1C(=O)CC(C(=O)[O-])N2CC2)Cl.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 8750ug/kg (8.75mg/kg)   Archivum Immunologiae et Therapiae Experimentalis. Vol. 34, Pg. 333, 1986.