Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Piperazine, 1-methyl-4-((1-methyl-5-nitro-1H-imidazol-2-yl)methyl)-
RN: 54387-29-0
InChIKey: QBMDUIXCYDOTRQ-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C10-H17-N5-O2

Molecular Weight

  • 239.277
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 1-Methyl-4-((1-methyl-5-nitro-1H-imidazol-2-yl)methyl)piperazine
  • 5-25-09-00497 (Beilstein Handbook Reference)
  • BRN 0887947
  • DA 3804

Systematic Name

  • Piperazine, 1-methyl-4-((1-methyl-5-nitro-1H-imidazol-2-yl)methyl)-

Registry Numbers

CAS Registry Number

  • 54387-29-0

System Generated Number

  • 0054387290

Structure Descriptors

InChI

1S/C10H17N5O2/c1-12-3-5-14(6-4-12)8-9-11-7-10(13(9)2)15(16)17/h7H,3-6,8H2,1-2H3

InChIKey

QBMDUIXCYDOTRQ-UHFFFAOYSA-N

Smiles

n1(C)c([N+]([O-])=O)cnc1CN1CCN(C)CC1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -0.32 (none)   EXP
Water Solubility 2.11E+05 mg/L 25 EST
Vapor Pressure 3.89E-07 mm Hg 25 EST
Henry's Law Constant 5.02E-14 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.89E-10 cm3/molecule-sec 25 EST

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