ChemSpider 2D Image | 1-(Difluoromethoxy)-3-nitro-5-(trifluoromethyl)benzene | C8H4F5NO3

1-(Difluoromethoxy)-3-nitro-5-(trifluoromethyl)benzene

  • Molecular FormulaC8H4F5NO3
  • Average mass257.114 Da
  • Monoisotopic mass257.011139 Da
  • ChemSpider ID24583753

More details:

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

1-(Difluormethoxy)-3-nitro-5-(trifluormethyl)benzol [German] [ACD/IUPAC Name]
1-(Difluoromethoxy)-3-nitro-5-(trifluoromethyl)benzene [ACD/IUPAC Name]
1-(Difluorométhoxy)-3-nitro-5-(trifluorométhyl)benzène [French] [ACD/IUPAC Name]
1227512-38-0 [RN]
Benzene, 1-(difluoromethoxy)-3-nitro-5-(trifluoromethyl)- [ACD/Index Name]
Difluoromethyl 3-nitro-5-(trifluoromethyl)phenyl ether
3-Difluoromethoxy-5-nitrobenzotrifluoride

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

Density: 1.5±0.1 g/cm3
Boiling Point: 243.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.1±3.0 kJ/mol
Flash Point: 101.0±27.3 °C
Index of Refraction: 1.439
Molar Refractivity: 44.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 3.12
ACD/BCF (pH 5.5): 138.56
ACD/KOC (pH 5.5): 1187.37
ACD/LogD (pH 7.4): 3.12
ACD/BCF (pH 7.4): 138.56
ACD/KOC (pH 7.4): 1187.37
Polar Surface Area: 55 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 28.5±3.0 dyne/cm
Molar Volume: 170.1±3.0 cm3

Click to predict properties on the Chemicalize site


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