ChemSpider 2D Image | Difluoro(6-fluoro-5-nitro-1H-benzimidazol-2-yl)acetic acid | C9H4F3N3O4

Difluoro(6-fluoro-5-nitro-1H-benzimidazol-2-yl)acetic acid

  • Molecular FormulaC9H4F3N3O4
  • Average mass275.141 Da
  • Monoisotopic mass275.015381 Da
  • ChemSpider ID93768468

More details:

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

1H-Benzimidazole-2-acetic acid, α,α,6-trifluoro-5-nitro- [ACD/Index Name]
Acide difluoro(6-fluoro-5-nitro-1H-benzimidazol-2-yl)acétique [French] [ACD/IUPAC Name]
Difluor(6-fluor-5-nitro-1H-benzimidazol-2-yl)essigsäure [German] [ACD/IUPAC Name]
Difluoro(6-fluoro-5-nitro-1H-benzimidazol-2-yl)acetic acid [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.8±0.1 g/cm3
Boiling Point: 553.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.7±3.0 kJ/mol
Flash Point: 288.3±30.1 °C
Index of Refraction: 1.640
Molar Refractivity: 54.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.20
ACD/LogD (pH 5.5): -1.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 112 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 71.2±3.0 dyne/cm
Molar Volume: 150.3±3.0 cm3

Click to predict properties on the Chemicalize site


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