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Substance Name: 3-Cyclohexene-1-carboxylic acid, 5-ethyl-4-(p-hydroxyphenyl)-6-methyl-, sodium salt
RN: 22921-18-2
InChIKey: YPTCKQVWMFTJCM-UHFFFAOYSA-M

Classification Code

  • Reproductive Effect

Molecular Formula

  • C16-H19-O3.Na

Molecular Weight

  • 282.313
 
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Names and Synonyms

Synonyms

  • 2-Methyl-3-ethyl-4-p-hydroxyphenyl-delta(sup 4)-cyclohexene carboxylic acid sodium salt
  • 5-Ethyl-4-(p-hydroxyphenyl)-6-methyl-3-cyclohexene-1-carboxylic acid sodium salt
  • ORF 6128

Systematic Name

  • 3-Cyclohexene-1-carboxylic acid, 5-ethyl-4-(p-hydroxyphenyl)-6-methyl-, sodium salt

Registry Numbers

CAS Registry Number

  • 22921-18-2

System Generated Number

  • 0022921182

Molecular Formulas

Molecular Formula

  • C16-H19-O3.Na

Molecular Formula Fragments

  • C16-H19-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C16H20O3.Na/c1-3-13-10(2)14(16(18)19)8-9-15(13)11-4-6-12(17)7-5-11;/h4-7,9-10,13-14,17H,3,8H2,1-2H3,(H,18,19);/q;+1/p-1

InChIKey

YPTCKQVWMFTJCM-UHFFFAOYSA-M

Smiles

[Na+].C1[C@@H]([C@@H]([C@@H](C(=C1)c1ccc(cc1)O)CC)C)C(=O)[O-]