ChemSpider 2D Image | 4-(2-Fluoro-1,1-dimethoxyethyl)benzoic acid | C11H13FO4

4-(2-Fluoro-1,1-dimethoxyethyl)benzoic acid

  • Molecular FormulaC11H13FO4
  • Average mass228.217 Da
  • Monoisotopic mass228.079788 Da
  • ChemSpider ID65422898

More details:

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

4-(2-Fluor-1,1-dimethoxyethyl)benzoesäure [German] [ACD/IUPAC Name]
4-(2-Fluoro-1,1-dimethoxyethyl)benzoic acid [ACD/IUPAC Name]
Acide 4-(2-fluoro-1,1-diméthoxyéthyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(2-fluoro-1,1-dimethoxyethyl)- [ACD/Index Name]
2225136-01-4 [RN]
MFCD31666437

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

Density: 1.2±0.1 g/cm3
Boiling Point: 328.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.3±3.0 kJ/mol
Flash Point: 152.5±27.9 °C
Index of Refraction: 1.503
Molar Refractivity: 55.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.35
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 1.59
ACD/KOC (pH 5.5): 20.08
ACD/LogD (pH 7.4): -0.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 56 Å2
Polarizability: 21.9±0.5 10-24cm3
Surface Tension: 38.8±3.0 dyne/cm
Molar Volume: 186.8±3.0 cm3

Click to predict properties on the Chemicalize site


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