ChemSpider 2D Image | Ethyl 2,2-difluoro-3-nitropropanoate | C5H7F2NO4

Ethyl 2,2-difluoro-3-nitropropanoate

  • Molecular FormulaC5H7F2NO4
  • Average mass183.110 Da
  • Monoisotopic mass183.034317 Da
  • ChemSpider ID75538808

More details:

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

2,2-Difluoro-3-nitropropanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 2,2-difluoro-3-nitropropanoate [ACD/IUPAC Name]
Ethyl-2,2-difluor-3-nitropropanoat [German] [ACD/IUPAC Name]
Propanoic acid, 2,2-difluoro-3-nitro-, ethyl ester [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: 225.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.2±3.0 kJ/mol
Flash Point: 90.1±27.3 °C
Index of Refraction: 1.397
Molar Refractivity: 33.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.03
ACD/LogD (pH 5.5): 1.39
ACD/BCF (pH 5.5): 6.41
ACD/KOC (pH 5.5): 125.20
ACD/LogD (pH 7.4): 0.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.60
Polar Surface Area: 72 Å2
Polarizability: 13.2±0.5 10-24cm3
Surface Tension: 31.8±3.0 dyne/cm
Molar Volume: 138.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement