ChemSpider 2D Image | 2-({[4-(Difluoromethoxy)-5-methoxy-2-nitrobenzoyl]amino}methyl)-2-ethylbutanoic acid | C16H20F2N2O7

2-({[4-(Difluoromethoxy)-5-methoxy-2-nitrobenzoyl]amino}methyl)-2-ethylbutanoic acid

  • Molecular FormulaC16H20F2N2O7
  • Average mass390.336 Da
  • Monoisotopic mass390.123871 Da
  • ChemSpider ID54361791

More details:

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

2-({[4-(Difluormethoxy)-5-methoxy-2-nitrobenzoyl]amino}methyl)-2-ethylbutansäure [German] [ACD/IUPAC Name]
2-({[4-(Difluoromethoxy)-5-methoxy-2-nitrobenzoyl]amino}methyl)-2-ethylbutanoic acid [ACD/IUPAC Name]
Acide 2-({[4-(difluorométhoxy)-5-méthoxy-2-nitrobenzoyl]amino}méthyl)-2-éthylbutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 2-[[[4-(difluoromethoxy)-5-methoxy-2-nitrobenzoyl]amino]methyl]-2-ethyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 524.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 84.1±3.0 kJ/mol
Flash Point: 271.2±30.1 °C
Index of Refraction: 1.519
Molar Refractivity: 89.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.06
ACD/LogD (pH 5.5): 1.06
ACD/BCF (pH 5.5): 2.05
ACD/KOC (pH 5.5): 28.03
ACD/LogD (pH 7.4): -0.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 131 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 294.6±3.0 cm3

Click to predict properties on the Chemicalize site


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