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Substance Name: 4-Benzofuranbutyric acid, 7-methoxy-gamma-oxo-, sodium salt
RN: 73698-63-2
InChIKey: NKCQFWAKMFNJOZ-UHFFFAOYSA-M

Molecular Formula

  • C13-H11-O5.Na

Molecular Weight

  • 270.215
 
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Names and Synonyms

Synonym

  • Sodium 7-methoxy-gamma-oxo-4-benzofuranbutyrate

Systematic Name

  • 4-Benzofuranbutyric acid, 7-methoxy-gamma-oxo-, sodium salt

Registry Numbers

CAS Registry Number

  • 73698-63-2

System Generated Number

  • 0073698632

Molecular Formulas

Molecular Formula

  • C13-H11-O5.Na

Molecular Formula Fragments

  • C13-H11-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C13H12O5.Na/c1-17-11-4-2-8(9-6-7-18-13(9)11)10(14)3-5-12(15)16;/h2,4,6-7H,3,5H2,1H3,(H,15,16);/q;+1/p-1

InChIKey

NKCQFWAKMFNJOZ-UHFFFAOYSA-M

Smiles

c12c(c(ccc1C(CCC(=O)[O-])=O)OC)occ2.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 1230mg/kg (1230mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 20, Pg. 676, 1970.