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Substance Name: 2-Cyclohexene-1-octanoic acid, 5(or 6)-carboxy-4-hexyl-, sodium salt (1:2)
RN: 56453-08-8
InChIKey: UAQIGVSGAWVUTO-UHFFFAOYSA-L

Molecular Formula

  • C21-H36-O4.2Na

Molecular Weight

  • 396.476
 
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Names and Synonyms

Synonyms

  • 2-Cyclohexene-1-octanoic acid, 5(or 6)-carboxy-4-hexyl-, disodium salt
  • 5(6)-Carboxy-4-hexyl-2-cyclohexene-1-octanoic acid, disodium salt
  • C19-Alkyldicarboxylic acid, disodium salt
  • EINECS 260-189-2
  • omega-5(6)-Carboxy-4-hexyl-2-cyclohexeneoctanoic acid, sodium salt

Systematic Names

  • 2-Cyclohexene-1-octanoic acid, 5(or 6)-carboxy-4-hexyl-, disodium salt
  • 2-Cyclohexene-1-octanoic acid, 5(or 6)-carboxy-4-hexyl-, sodium salt (1:2)
  • Disodium 5(or 6)-carboxylato-4-hexylcyclohex-2-ene-1-octanoate

Registry Numbers

CAS Registry Number

  • 56453-08-8

System Generated Number

  • 0056453088

Molecular Formulas

Molecular Formula

  • C21-H36-O4.2Na

Molecular Formula Fragments

  • C21-H36-O4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C21H36O4.2Na/c1-2-3-4-9-12-18-15-14-17(16-19(18)21(24)25)11-8-6-5-7-10-13-20(22)23;;/h14-15,17-19H,2-13,16H2,1H3,(H,22,23)(H,24,25);;/q;2*+1/p-2

InChIKey

UAQIGVSGAWVUTO-UHFFFAOYSA-L

Smiles

[Na+].[Na+].C=1[C@@H](C[C@@H]([C@@H](C1)CCCCCC)C(=O)[O-])CCCCCCCC(=O)[O-]