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Substance Name: Nicofibrate [INN]
RN: 31980-29-7
UNII: 4839MB71E7
InChIKey: RARQHAFNGNPQCZ-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Vasodilator

Molecular Formula

  • C16-H16-Cl-N-O3

Molecular Weight

  • 305.759
 
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Names and Synonyms

Name of Substance

  • Nicofibrate
  • Nicofibrate [INN]

Synonyms

  • 3-Pyridylmethyl 2-(p-chlorophenoxy)-2-methylpropionate
  • 5-21-02-00176 (Beilstein Handbook Reference)
  • BRN 1542952
  • Clofenpyrid
  • EINECS 250-880-7
  • Nicofibrate
  • Nicofibrato
  • Nicofibrato [DCIT]
  • Nicofibratum
  • Nicofibratum [INN-Latin]
  • UNII-4839MB71E7

Systematic Names

  • 3-Pyridylmethyl 2-(p-chlorophenoxy)-2-methylpropionate
  • Nicofibrate
  • Propionic acid, 2-(p-chlorophenoxy)-2-methyl-, 3-pyridylmethyl ester

Registry Numbers

CAS Registry Number

  • 31980-29-7

FDA UNII

  • 4839MB71E7

System Generated Number

  • 0031980297

Structure Descriptors

InChI

1S/C16H16ClNO3/c1-16(2,21-14-7-5-13(17)6-8-14)15(19)20-11-12-4-3-9-18-10-12/h3-10H,11H2,1-2H3

InChIKey

RARQHAFNGNPQCZ-UHFFFAOYSA-N

Smiles

c1(ccc(cc1)OC(C)(C(OCc1cccnc1)=O)C)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2gm/kg (2000mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 90, Pg. 921, 1970.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 48.5 deg C   EXP
log P (octanol-water) 3.650 (none)   EST
Atmospheric OH Rate Constant 9.64E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.