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Substance Name: Cyclopentanehexanoic acid, beta-hydroxy-beta,2,2,3-tetramethyl-, sodium salt
RN: 57272-28-3
InChIKey: BMQSKAWWTIRIBY-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H27-O3.Na

Molecular Weight

  • 278.3653
 
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Names and Synonyms

Synonyms

  • beta-Hydroxy-beta,2,2,3-tetramethylcyclopentanehexanoic acid sodium salt
  • beta-Hydroxy-beta,2,2,3-tetramethylcyclopentylpentanecarboxylic acid sodium salt
  • Sodium beta-hydroxy-beta,2,2,3-tetramethylcyclopentanehexanoate

Systematic Name

  • Cyclopentanehexanoic acid, beta-hydroxy-beta,2,2,3-tetramethyl-, sodium salt

Registry Numbers

CAS Registry Number

  • 57272-28-3

System Generated Number

  • 0057272283

Molecular Formulas

Molecular Formula

  • C15-H27-O3.Na

Molecular Formula Fragments

  • C15-H27-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C15H28O3.Na/c1-11-7-8-12(14(11,2)3)6-5-9-15(4,18)10-13(16)17;/h11-12,18H,5-10H2,1-4H3,(H,16,17);/q;+1/p-1

InChIKey

BMQSKAWWTIRIBY-UHFFFAOYSA-M

Smiles

CC1CCC(C1(C)C)CCCC(C)(CC(=O)[O-])O.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 335mg/kg (335mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 27, Pg. 399, 1975.