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Substance Name: Butibufen sodium
RN: 60682-24-8
UNII: 33KW1RW80I
InChIKey: SJBWJHOBCVAGGD-UHFFFAOYSA-M

Molecular Formula

  • C14-H20-O2.Na

Molecular Weight

  • 242.292
 
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Names and Synonyms

Name of Substance

  • Butibufen sodium

Synonyms

  • EINECS 262-374-3
  • UNII-33KW1RW80I

Systematic Name

  • Sodium 2-(4-isobutylphenyl)butyrate

Registry Numbers

CAS Registry Number

  • 60682-24-8

FDA UNII

  • 33KW1RW80I

Related Registry Number

  • 55837-18-8 (Parent)

System Generated Number

  • 0060682248

Molecular Formulas

Molecular Formula

  • C14-H20-O2.Na

Molecular Formula Fragments

  • C14-H20-O2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C14H20O2.Na/c1-4-13(14(15)16)12-7-5-11(6-8-12)9-10(2)3;/h5-8,10,13H,4,9H2,1-3H3,(H,15,16);/q;+1/p-1

InChIKey

SJBWJHOBCVAGGD-UHFFFAOYSA-M

Smiles

[Na+].c1(ccc(cc1)CC(C)C)[C@@H](C(=O)[O-])CC