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Substance Name: 3-Pyridinecarboxylic acid, 2-cyclohexylphenyl ester, hydrochloride
RN: 76928-34-2
InChIKey: KDWWTXCFEYTIEL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H19-N-O2.Cl-H

Molecular Weight

  • 317.814
 
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Names and Synonyms

Synonyms

  • Nicotinic acid, o-cyclohexylphenyl ester, hydrochloride
  • o-Cyclohexylphenyl nicotinate hydrochloride

Systematic Name

  • 3-Pyridinecarboxylic acid, 2-cyclohexylphenyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 76928-34-2

System Generated Number

  • 0076928342

Molecular Formulas

Molecular Formula

  • C18-H19-N-O2.Cl-H

Molecular Formula Fragments

  • C18-H19-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H19NO2.ClH/c20-18(15-9-6-12-19-13-15)21-17-11-5-4-10-16(17)14-7-2-1-3-8-14;/h4-6,9-14H,1-3,7-8H2;1H

InChIKey

KDWWTXCFEYTIEL-UHFFFAOYSA-N

Smiles

c1ccc(c(c1)C2CCCCC2)OC(=O)c3cccnc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 unreported 2050mg/kg (2050mg/kg)   United States Patent Document. Vol. #4412998,