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Substance Name: Cyclohexanecarboxylic acid, 1-(2-hydroxypropyl)-, sodium salt
RN: 77945-13-2
InChIKey: UNINIFVJWXEDAX-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H17-O3.Na

Molecular Weight

  • 208.2313
 
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Names and Synonyms

Synonyms

  • 1-(2-Hydroxypropyl)cyclohexanecarboxylic acid sodium salt
  • alpha,alpha-Pentamethylen-gamma-hydroxy-valeriansaeure natriumsalz
  • alpha,alpha-Pentamethylen-gamma-hydroxy-valeriansaeure natriumsalz [German]

Systematic Name

  • Cyclohexanecarboxylic acid, 1-(2-hydroxypropyl)-, sodium salt

Registry Numbers

CAS Registry Number

  • 77945-13-2

System Generated Number

  • 0077945132

Molecular Formulas

Molecular Formula

  • C10-H17-O3.Na

Molecular Formula Fragments

  • C10-H17-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C10H18O3.Na/c1-8(11)7-10(9(12)13)5-3-2-4-6-10;/h8,11H,2-7H2,1H3,(H,12,13);/q;+1/p-1

InChIKey

UNINIFVJWXEDAX-UHFFFAOYSA-M

Smiles

CC(CC1(CCCCC1)C(=O)[O-])O.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 800mg/kg (800mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Arzneimittel-Forschung. Drug Research. Vol. 10, Pg. 243, 1960.