ChemSpider 2D Image | 2-Fluoro-4-(3,3,3-trifluoropropoxy)benzoic acid | C10H8F4O3

2-Fluoro-4-(3,3,3-trifluoropropoxy)benzoic acid

  • Molecular FormulaC10H8F4O3
  • Average mass252.162 Da
  • Monoisotopic mass252.040955 Da
  • ChemSpider ID28572798

More details:

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

2-Fluor-4-(3,3,3-trifluorpropoxy)benzoesäure [German] [ACD/IUPAC Name]
2-Fluoro-4-(3,3,3-trifluoropropoxy)benzoic acid [ACD/IUPAC Name]
Acide 2-fluoro-4-(3,3,3-trifluoropropoxy)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-fluoro-4-(3,3,3-trifluoropropoxy)- [ACD/Index Name]
921623-34-9 [RN]
MFCD27932992

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

Density: 1.4±0.1 g/cm3
Boiling Point: 276.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.4±3.0 kJ/mol
Flash Point: 121.2±27.3 °C
Index of Refraction: 1.464
Molar Refractivity: 49.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.75
ACD/LogD (pH 5.5): 0.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.89
ACD/LogD (pH 7.4): -0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 47 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 34.9±3.0 dyne/cm
Molar Volume: 179.6±3.0 cm3

Click to predict properties on the Chemicalize site


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