ChemSpider 2D Image | MFCD16652531 | C413C2H9N15N2O3

MFCD16652531

  • Molecular FormulaC413C2H9N15N2O3
  • Average mass175.126 Da
  • Monoisotopic mass175.065170 Da
  • ChemSpider ID49071691
  • Non-standard isotope - Non-standard isotope


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1173020-03-5 [RN]
1H-Imidazole-2-13C-1,3-15N2-1-ethanol, 2-(methyl-13C)-5-nitro- [ACD/Index Name]
2-(Methyl-13C)-5-nitro(imidazole-2-13C-1,3-15N2)-1-ethanol
2-[2-(13C)Methyl-5-nitro(2-13C,15N2)-1H-imidazol-1-yl]ethanol [German] [ACD/IUPAC Name]
2-[2-(13C)Methyl-5-nitro(2-13C,15N2)-1H-imidazol-1-yl]ethanol [ACD/IUPAC Name]
2-[2-(13C)Méthyl-5-nitro(2-13C,15N2)-1H-imidazol-1-yl]éthanol [French] [ACD/IUPAC Name]
Metronidazole-13C2,15N2
MFCD16652531
2-(2-(113C)Methyl-5-nitro(213C,1,3-15N2)imidazol-1-yl)ethanol
2-[2-(13C)Methyl-5-nitro(2-13C,15N2)-1H-imidazol-1-yl]ethan-1-ol

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.612
Molar Refractivity: 41.0±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 60.5±7.0 dyne/cm
Molar Volume: 117.9±7.0 cm3

Click to predict properties on the Chemicalize site






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