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Substance Name: Picolinic acid, 5-octyl-
RN: 26405-30-1
InChIKey: TVASHDLWKCMJDO-UHFFFAOYSA-N

Molecular Formula

  • C14-H21-N-O2

Molecular Weight

  • 235.325
 
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Names and Synonyms

Synonyms

  • 5-22-02-00402 (Beilstein Handbook Reference)
  • 5-Octyl-2-pyridinecarboxylic acid
  • 5-Octylpicolinic acid
  • BRN 0475010

Systematic Names

  • 2-Pyridinecarboxylic acid, 5-octyl- (9CI)
  • Picolinic acid, 5-octyl-

Registry Numbers

CAS Registry Number

  • 26405-30-1

System Generated Number

  • 0026405301

Structure Descriptors

InChI

1S/C14H21NO2/c1-2-3-4-5-6-7-8-12-9-10-13(14(16)17)15-11-12/h9-11H,2-8H2,1H3,(H,16,17)

InChIKey

TVASHDLWKCMJDO-UHFFFAOYSA-N

Smiles

c1(ccc(cn1)CCCCCCCC)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 62mg/kg (62mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 17, Pg. 2377, 1969.