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Substance Name: 4-(4-Nitrobenzyl)pyridine
RN: 1083-48-3
UNII: 0Z6GS37N7H
InChIKey: MNHKUCBXXMFQDM-UHFFFAOYSA-N

Note

  • Reagent for determination of organophosphorus pesticides spectrophotometrically.

Molecular Formula

  • C12-H10-N2-O2

Molecular Weight

  • 214.223
 

Classification Codes

  • Chromogenic Compounds
  • Coloring Agents
  • Indicators and Reagents
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Names and Synonyms

Name of Substance

  • 4-(4-Nitrobenzyl)pyridine

Synonyms

  • 1-(p-Nitrobenzyl)pyridine
  • 4(4-Nitrobenzyl)primide
  • 4-(4-Nitrobenzyl)pyridine
  • 4-Nitrobenzylpyridine
  • 5-20-07-00564 (Beilstein Handbook Reference)
  • BRN 0170877
  • EINECS 214-108-2
  • gamma-(p-Nitrobenzyl)pyridine
  • NSC 83591
  • UNII-0Z6GS37N7H

Systematic Names

  • 4-(4-Nitrobenzyl)pyridine
  • Pyridine, 4-((4-nitrophenyl)methyl)-
  • Pyridine, 4-(p-nitrobenzyl)-

Registry Numbers

CAS Registry Number

  • 1083-48-3

FDA UNII

  • 0Z6GS37N7H

System Generated Number

  • 0001083483

Structure Descriptors

InChI

1S/C12H10N2O2/c15-14(16)12-3-1-10(2-4-12)9-11-5-7-13-8-6-11/h1-8H,9H2

InChIKey

MNHKUCBXXMFQDM-UHFFFAOYSA-N

Smiles

c1(Cc2ccncc2)ccc([N+]([O-])=O)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 89mg/kg (89mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#12116,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 70-72 deg C   EXP
log P (octanol-water) 2.88 (none)   EXP
Water Solubility 1040 mg/L 25 EST
Vapor Pressure 2.01E-05 mm Hg 25 EST
Henry's Law Constant 2.48E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.46E-12 cm3/molecule-sec 25 EST

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