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Substance Name: 1-Chloro-2,6,10-trimethylundecan-1-carboxylic acid
RN: 57272-19-2
InChIKey: VSFVFOJDFFIRDL-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H28-Cl-O2.Na

Molecular Weight

  • 298.827
 
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Names and Synonyms

Name of Substance

  • 1-Chloro-2,6,10-trimethylundecan-1-carboxylic acid

Synonyms

  • 1-Chloro-2,6,10-trojmetylo-undekanokarboksylowego-1 sodowe kwasow
  • 1-Chloro-2,6,10-trojmetylo-undekanokarboksylowego-1 sodowe kwasow [Polish]
  • 2-Chloro-3,7,11-trimethyllauric acid sodium salt
  • Dodecanoic acid, 2-chloro-3,7,11-trimethyl-, sodium salt
  • Sodium 2-chloro-3,7,11-trimethyldodecanoate
  • Sodium salt of 1-chloro-2,6,10-trimethylundecane-1-carboxylic acid

Systematic Names

  • 2-Chloro-3,7,11-trimethyldodecanoic acid
  • Lauric acid, 2-chloro-3,7,11-trimethyl-, sodium salt

Registry Numbers

CAS Registry Number

  • 57272-19-2

System Generated Number

  • 0057272192

Molecular Formulas

Molecular Formula

  • C15-H28-Cl-O2.Na

Molecular Formula Fragments

  • C15-H28-Cl-O2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C15H29ClO2.Na/c1-11(2)7-5-8-12(3)9-6-10-13(4)14(16)15(17)18;/h11-14H,5-10H2,1-4H3,(H,17,18);/q;+1/p-1

InChIKey

VSFVFOJDFFIRDL-UHFFFAOYSA-M

Smiles

[Na+].C([C@@H]([C@@H](CCC[C@@H](CCCC(C)C)C)C)Cl)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 235mg/kg (235mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 27, Pg. 399, 1975.