ChemSpider 2D Image | Dimethyl 2-(4-nitrophenyl)-3-[4-(trifluoromethyl)phenoxy]-1,1-cyclopropanedicarboxylate | C20H16F3NO7

Dimethyl 2-(4-nitrophenyl)-3-[4-(trifluoromethyl)phenoxy]-1,1-cyclopropanedicarboxylate

  • Molecular FormulaC20H16F3NO7
  • Average mass439.339 Da
  • Monoisotopic mass439.087891 Da
  • ChemSpider ID30780567

More details:

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

1,1-Cyclopropanedicarboxylic acid, 2-(4-nitrophenyl)-3-[4-(trifluoromethyl)phenoxy]-, dimethyl ester [ACD/Index Name]
2-(4-Nitrophényl)-3-[4-(trifluorométhyl)phénoxy]-1,1-cyclopropanedicarboxylate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 2-(4-nitrophenyl)-3-[4-(trifluoromethyl)phenoxy]-1,1-cyclopropanedicarboxylate [ACD/IUPAC Name]
Dimethyl-2-(4-nitrophenyl)-3-[4-(trifluormethyl)phenoxy]-1,1-cyclopropandicarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 491.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 251.0±28.7 °C
Index of Refraction: 1.553
Molar Refractivity: 97.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.28
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 1046.90
ACD/KOC (pH 5.5): 5049.50
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 1046.90
ACD/KOC (pH 7.4): 5049.50
Polar Surface Area: 108 Å2
Polarizability: 38.8±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 305.9±3.0 cm3

Click to predict properties on the Chemicalize site


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