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Substance Name: 4-Pyridinecarbonitrile, 1-oxide
RN: 14906-59-3
InChIKey: QNCSFBSIWVBTHE-UHFFFAOYSA-N

Molecular Formula

  • C6-H4-N2-O

Molecular Weight

  • 120.111
 
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Names and Synonyms

Synonyms

  • 4-Cyanopyridine 1-oxide
  • 4-Cyanopyridine N-oxide
  • 4-Cyanopyridine oxide
  • 4-Pyridinecarbonitrile 1-oxide
  • AI3-62176
  • EINECS 238-974-6
  • NSC 132883

Systematic Names

  • 4-Pyridinecarbonitrile, 1-oxide
  • Isonicotinonitrile 1-oxide

Registry Numbers

CAS Registry Number

  • 14906-59-3

System Generated Number

  • 0014906593

Structure Descriptors

InChI

1S/C6H4N2O/c7-5-6-1-3-8(9)4-2-6/h1-4H

InChIKey

QNCSFBSIWVBTHE-UHFFFAOYSA-N

Smiles

N#Cc1ccn(=O)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 223-225 deg C   EXP
log P (octanol-water) -0.94 (none)   EXP
Water Solubility 3.46E+05 mg/L 25 EST
Vapor Pressure 1.72E-03 mm Hg 25 EST
Henry's Law Constant 6.81E-13 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.53E-14 cm3/molecule-sec 25 EST

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