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Substance Name: Nicoclonate hydrochloride
RN: 10400-20-1
InChIKey: WFOSBBBLIAVCRP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H16-Cl-N-O2.Cl-H

Molecular Weight

  • 326.221
 
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Names and Synonyms

Results Name

  • Nicoclonate hydrochloride

Synonyms

  • 1-(p-Chlorophenyl)-1-(nicotinoyloxy)-2-methylpropane hydrochloride
  • 1-(p-Chlorophenyl)isobutyl nicotinate hydrochloride
  • Lipidium hydrochloride
  • Nicoclonate HCl
  • Nicoclonate hydrochloride
  • p-Chlorophenylisopropylcarbinol nicotinate hydrochloride
  • S 486 hydrochloride

Systematic Name

  • Nicotinic acid, p-chloro-alpha-isopropylbenzyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 10400-20-1

System Generated Number

  • 0010400201

Molecular Formulas

Molecular Formula

  • C16-H16-Cl-N-O2.Cl-H

Molecular Formula Fragments

  • C16-H16-Cl-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H16ClNO2.ClH/c1-11(2)15(12-5-7-14(17)8-6-12)20-16(19)13-4-3-9-18-10-13;/h3-11,15H,1-2H3;1H

InChIKey

WFOSBBBLIAVCRP-UHFFFAOYSA-N

Smiles

c1c(cccn1)C(=O)O[C@@H](C(C)C)c1ccc(cc1)Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2270mg/kg (2270mg/kg)   United States Patent Document. Vol. #3367939,