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Substance Name: 4-Benzofuranbutyric acid, 7-methoxy-2-methyl-gamma-oxo-, sodium salt
RN: 73698-62-1
InChIKey: OCDABBNBWHJMFH-UHFFFAOYSA-M

Molecular Formula

  • C14-H13-O5.Na

Molecular Weight

  • 284.242
 
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Names and Synonyms

Synonym

  • Sodium 7-methoxy-2-methyl-gamma-oxo-4-benzofuranbutyrate

Systematic Name

  • 4-Benzofuranbutyric acid, 7-methoxy-2-methyl-gamma-oxo-, sodium salt

Registry Numbers

CAS Registry Number

  • 73698-62-1

System Generated Number

  • 0073698621

Molecular Formulas

Molecular Formula

  • C14-H13-O5.Na

Molecular Formula Fragments

  • C14-H13-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C14H14O5.Na/c1-8-7-10-9(11(15)4-6-13(16)17)3-5-12(18-2)14(10)19-8;/h3,5,7H,4,6H2,1-2H3,(H,16,17);/q;+1/p-1

InChIKey

OCDABBNBWHJMFH-UHFFFAOYSA-M

Smiles

c12c(c(ccc1C(CCC(=O)[O-])=O)OC)oc(c2)C.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 2160mg/kg (2160mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 20, Pg. 676, 1970.