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Substance Name: 6-Benzofuranbutyric acid, 2,3-dimethyl-7-methoxy-gamma-oxo-, sodium salt
RN: 73698-60-9
InChIKey: LNHXCSJAXIAVDY-UHFFFAOYSA-M

Molecular Formula

  • C15-H15-O5.Na

Molecular Weight

  • 298.268
 
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Names and Synonyms

Synonym

  • Sodium 7-methoxy-2,3-dimethyl-gamma-oxo-6-benzofuranbutyrate

Systematic Name

  • 6-Benzofuranbutyric acid, 2,3-dimethyl-7-methoxy-gamma-oxo-, sodium salt

Registry Numbers

CAS Registry Number

  • 73698-60-9

System Generated Number

  • 0073698609

Molecular Formulas

Molecular Formula

  • C15-H15-O5.Na

Molecular Formula Fragments

  • C15-H15-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C15H16O5.Na/c1-8-9(2)20-15-10(8)4-5-11(14(15)19-3)12(16)6-7-13(17)18;/h4-5H,6-7H2,1-3H3,(H,17,18);/q;+1/p-1

InChIKey

LNHXCSJAXIAVDY-UHFFFAOYSA-M

Smiles

c12c(c(ccc1c(C)c(o2)C)C(CCC(=O)[O-])=O)OC.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 3gm/kg (3000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 20, Pg. 676, 1970.