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Substance Name: Menidazole
RN: 696-23-1
UNII: 24AG2WW15W
InChIKey: FFYTTYVSDVWNMY-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C4-H5-N3-O2

Molecular Weight

  • 127.103
 
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Names and Synonyms

Results Name

  • Menidazole

Name of Substance

  • 2-Methyl-5-nitroimidazole
  • Menidazole

Synonyms

  • 2-Methyl-4-nitroimidazole
  • 2-Methyl-5-nitroimidazole
  • EC 211-790-3
  • EINECS 211-790-3
  • Imidazole, 2-methyl-4-nitro-
  • Menidazole
  • RP 8532
  • UNII-24AG2WW15W

Systematic Names

  • 1H-Imidazole, 2-methyl-4-nitro-
  • 1H-Imidazole, 2-methyl-5-nitro-
  • 2-Methyl-4-nitroimidazole
  • 2-Methyl-5-nitro-1H-imidazole (9CI)
  • Imidazole, 2-methyl-5-nitro-

Registry Numbers

CAS Registry Number

  • 696-23-1

FDA UNII

  • 24AG2WW15W

Other Registry Numbers

  • 100215-29-0
  • 88054-22-2

System Generated Number

  • 0000696231

Structure Descriptors

InChI

1S/C4H5N3O2/c1-3-5-2-4(6-3)7(8)9/h2H,1H3,(H,5,6)

InChIKey

FFYTTYVSDVWNMY-UHFFFAOYSA-N

Smiles

c1([nH]c(C)nc1)[N+](=O)[O-]

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.420 (none)   EST
Water Solubility 2.01E+04 mg/L 25 EST
Vapor Pressure 6.48E-05 mm Hg 25 EST
Henry's Law Constant 1.64E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.99E-12 cm3/molecule-sec 25 EST

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