ChemSpider 2D Image | 2-(2-Nitro-1H-imidazol-1-yl)-N-[(2R)-3,3,3-trifluoro-2-hydroxypropyl]acetamide | C8H9F3N4O4

2-(2-Nitro-1H-imidazol-1-yl)-N-[(2R)-3,3,3-trifluoro-2-hydroxypropyl]acetamide

  • Molecular FormulaC8H9F3N4O4
  • Average mass282.177 Da
  • Monoisotopic mass282.057587 Da
  • ChemSpider ID34988591
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

1H-Imidazole-1-acetamide, 2-nitro-N-[(2R)-3,3,3-trifluoro-2-hydroxypropyl]- [ACD/Index Name]
2-(2-Nitro-1H-imidazol-1-yl)-N-[(2R)-3,3,3-trifluor-2-hydroxypropyl]acetamid [German] [ACD/IUPAC Name]
2-(2-Nitro-1H-imidazol-1-yl)-N-[(2R)-3,3,3-trifluoro-2-hydroxypropyl]acetamide [ACD/IUPAC Name]
2-(2-Nitro-1H-imidazol-1-yl)-N-[(2R)-3,3,3-trifluoro-2-hydroxypropyl]acétamide [French] [ACD/IUPAC Name]
167648-73-9 [RN]
SR-4554
UNII-9JA4Q7568M

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.565
Molar Refractivity: 54.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.29
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.72
ACD/LogD (pH 7.4): -0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.72
Polar Surface Area: 113 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 54.5±7.0 dyne/cm
Molar Volume: 167.2±7.0 cm3

Click to predict properties on the Chemicalize site






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