ChemSpider 2D Image | 5-(Difluoromethyl)-2-fluorobenzoic acid | C8H5F3O2

5-(Difluoromethyl)-2-fluorobenzoic acid

  • Molecular FormulaC8H5F3O2
  • Average mass190.119 Da
  • Monoisotopic mass190.024170 Da
  • ChemSpider ID45547784

More details:

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

5-(Difluormethyl)-2-fluorbenzoesäure [German] [ACD/IUPAC Name]
5-(Difluoromethyl)-2-fluorobenzoic acid [ACD/IUPAC Name]
Acide 5-(difluorométhyl)-2-fluorobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 5-(difluoromethyl)-2-fluoro- [ACD/Index Name]
1429421-95-3 [RN]
5-(difluoromethyl)-2-fluoro-Benzoic acid
5-?(difluoromethyl)?-?2-?fluoro-Benzoic acid
MFCD28402675

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

Density: 1.4±0.1 g/cm3
Boiling Point: 267.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.4±3.0 kJ/mol
Flash Point: 115.5±27.3 °C
Index of Refraction: 1.485
Molar Refractivity: 38.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.10
ACD/LogD (pH 7.4): -0.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 15.2±0.5 10-24cm3
Surface Tension: 37.1±3.0 dyne/cm
Molar Volume: 134.1±3.0 cm3

Click to predict properties on the Chemicalize site


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