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Substance Name: 1-Nitroso-4-piperidone
RN: 55556-91-7
InChIKey: ADLADNOVIJYIMA-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C5-H8-N2-O2

Molecular Weight

  • 128.13
 
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Names and Synonyms

Name of Substance

  • 1-Nitroso-4-piperidone

Synonyms

  • 4-Piperidone, 1-nitroso-
  • 5-21-06-00429 (Beilstein Handbook Reference)
  • BRN 0113762
  • CCRIS 5589
  • N-Nitroso-4-piperidinone
  • Nitroso-4-piperidinone
  • Nitroso-4-piperidone

Systematic Names

  • 4-Piperidinone, N-nitroso-
  • Nitroso-4-piperidone

Registry Numbers

CAS Registry Number

  • 55556-91-7

System Generated Number

  • 0055556917

Structure Descriptors

InChI

1S/C5H8N2O2/c8-5-1-3-7(6-9)4-2-5/h1-4H2

InChIKey

ADLADNOVIJYIMA-UHFFFAOYSA-N

Smiles

N1(CCC(=O)CC1)N=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -0.47 (none)   EXP
Water Solubility 2.36E+05 mg/L 25 EST
Vapor Pressure 5.55E-03 mm Hg 25 EST
Henry's Law Constant 8.10E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.95E-11 cm3/molecule-sec 25 EST

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