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Substance Name: Sodium isooctyl phthalate
RN: 94248-71-2
InChIKey: FBHDGNOSRSDXNN-UHFFFAOYSA-M

Molecular Formula

  • C16-H22-O4.Na

Molecular Weight

  • 300.3279
 
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Names and Synonyms

Synonym

  • EINECS 304-345-0

Systematic Name

  • Sodium isooctyl phthalate

Registry Numbers

CAS Registry Number

  • 94248-71-2

System Generated Number

  • 0094248712

Molecular Formulas

Molecular Formula

  • C16-H22-O4.Na

Molecular Formula Fragments

  • C16-H22-O4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C16H22O4.Na/c1-12(2)8-4-3-7-11-20-16(19)14-10-6-5-9-13(14)15(17)18;/h5-6,9-10,12H,3-4,7-8,11H2,1-2H3,(H,17,18);/q;+1/p-1

InChIKey

FBHDGNOSRSDXNN-UHFFFAOYSA-M

Smiles

c1(c(C(=O)OCCCCCC(C)C)cccc1)C(=O)[O-].[Na+]