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Substance Name: 1H-Imidazole, 2-cyclopropyl-1-methyl-5-nitro-
RN: 74550-87-1
InChIKey: DQOYEOYSZVBYQN-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C7-H9-N3-O2

Molecular Weight

  • 167.167
 
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Names and Synonyms

Synonyms

  • 2-Cyclopropyl-1-methyl-5-nitro-1H-imidazole
  • DA 3851

Systematic Name

  • 1H-Imidazole, 2-cyclopropyl-1-methyl-5-nitro-

Registry Numbers

CAS Registry Number

  • 74550-87-1

System Generated Number

  • 0074550871

Structure Descriptors

InChI

1S/C7H9N3O2/c1-9-6(10(11)12)4-8-7(9)5-2-3-5/h4-5H,2-3H2,1H3

InChIKey

DQOYEOYSZVBYQN-UHFFFAOYSA-N

Smiles

[O-][N+](=O)c1cnc(C2CC2)n1C

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1 (none)   EXP
Water Solubility 3620 mg/L 25 EST
Vapor Pressure 6.30E-05 mm Hg 25 EST
Henry's Law Constant 2.71E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.04E-12 cm3/molecule-sec 25 EST

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