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Substance Name: N-Nitroso-1,2,3,6-tetrahydropyridine
RN: 55556-92-8
InChIKey: KIUHZRUPPGAVPY-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C5-H8-N2-O

Molecular Weight

  • 112.131
 
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Names and Synonyms

Name of Substance

  • N-Nitroso-1,2,3,6-tetrahydropyridine

Synonyms

  • 1,2,3,6-Tetrahydro-1-nitrosopyridine
  • 5-20-04-00288 (Beilstein Handbook Reference)
  • BRN 1616955
  • N-Nitroso-1,2,3,6-tetrahydropyridine
  • N-Nitroso-delta(sup 3)-piperidine
  • N-Nitroso-delta(sup 3)-tetrahydropyridine
  • Nitroso-delta(sup 3)-piperidine
  • Pyridine, 1,2,5,6-tetrahydro-1-nitroso-
  • Pyridine, 1-nitroso-1,2,3,6-tetrahydro-

Systematic Name

  • Pyridine, 1,2,3,6-tetrahydro-1-nitroso-

Registry Numbers

CAS Registry Number

  • 55556-92-8

System Generated Number

  • 0055556928

Structure Descriptors

InChI

1S/C5H8N2O/c8-6-7-4-2-1-3-5-7/h1-2H,3-5H2

InChIKey

KIUHZRUPPGAVPY-UHFFFAOYSA-N

Smiles

N1(CCC=CC1)N=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.18 (none)   EXP
Water Solubility 1.05E+04 mg/L 25 EST
Vapor Pressure 0.107 mm Hg 25 EST
Henry's Law Constant 1.87E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.69E-11 cm3/molecule-sec 25 EST

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