ChemSpider 2D Image | (4,5-Dimethoxy-2-nitrophenyl)(3-{[4-(trifluoromethyl)-2-pyridinyl]oxy}-1-pyrrolidinyl)methanone | C19H18F3N3O6

(4,5-Dimethoxy-2-nitrophenyl)(3-{[4-(trifluoromethyl)-2-pyridinyl]oxy}-1-pyrrolidinyl)methanone

  • Molecular FormulaC19H18F3N3O6
  • Average mass441.358 Da
  • Monoisotopic mass441.114777 Da
  • ChemSpider ID39471143

More details:

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

(4,5-Dimethoxy-2-nitrophenyl)(3-{[4-(trifluormethyl)-2-pyridinyl]oxy}-1-pyrrolidinyl)methanon [German] [ACD/IUPAC Name]
(4,5-Dimethoxy-2-nitrophenyl)(3-{[4-(trifluoromethyl)-2-pyridinyl]oxy}-1-pyrrolidinyl)methanone [ACD/IUPAC Name]
(4,5-Diméthoxy-2-nitrophényl)(3-{[4-(trifluorométhyl)-2-pyridinyl]oxy}-1-pyrrolidinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, (4,5-dimethoxy-2-nitrophenyl)[3-[[4-(trifluoromethyl)-2-pyridinyl]oxy]-1-pyrrolidinyl]- [ACD/Index Name]
(4,5-dimethoxy-2-nitrophenyl)(3-((4-(trifluoromethyl)pyridin-2-yl)oxy)pyrrolidin-1-yl)methanone

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

Density: 1.4±0.1 g/cm3
Boiling Point: 611.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 323.6±31.5 °C
Index of Refraction: 1.558
Molar Refractivity: 100.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.20
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 55.30
ACD/KOC (pH 5.5): 615.26
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.31
ACD/KOC (pH 7.4): 615.31
Polar Surface Area: 107 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 312.9±3.0 cm3

Click to predict properties on the Chemicalize site


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