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Substance Name: 1-Nitroso-3,5-dimethylpiperazine
RN: 67774-31-6
InChIKey: LRRXQOLSXNHYGG-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C6-H13-N3-O

Molecular Weight

  • 143.189
 
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Names and Synonyms

Name of Substance

  • 1-Nitroso-3,5-dimethylpiperazine

Synonyms

  • 1-Nitroso-3,5-dimethylpiperazine
  • 3,5-Dimethyl-1-nitrosopiperazine
  • 5-23-03-00333 (Beilstein Handbook Reference)
  • BRN 0509433
  • CCRIS 1372
  • N-Nitroso-3,5-dimethylpiperazine
  • Nitroso-3,5-dimethylpiperazine

Systematic Names

  • 3,5-Dimethyl-1-nitrosopiperazine
  • Piperazine, 3,5-dimethyl-1-nitroso-

Registry Numbers

CAS Registry Number

  • 67774-31-6

System Generated Number

  • 0067774316

Structure Descriptors

InChI

1S/C6H13N3O/c1-5-3-9(8-10)4-6(2)7-5/h5-7H,3-4H2,1-2H3

InChIKey

LRRXQOLSXNHYGG-UHFFFAOYSA-N

Smiles

O=NN1C[C@@H](C)N[C@@H](C)C1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.73 (none)   EXP
Water Solubility 1.97E+05 mg/L 25 EST
Vapor Pressure 3.55E-03 mm Hg 25 EST
Henry's Law Constant 4.79E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.29E-10 cm3/molecule-sec 25 EST

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