ChemSpider 2D Image | (2E)-3-{3-Fluoro-4-[(3-methyl-2-buten-1-yl)oxy]phenyl}acrylic acid | C14H15FO3

(2E)-3-{3-Fluoro-4-[(3-methyl-2-buten-1-yl)oxy]phenyl}acrylic acid

  • Molecular FormulaC14H15FO3
  • Average mass250.266 Da
  • Monoisotopic mass250.100525 Da
  • ChemSpider ID26377484

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-{3-Fluor-4-[(3-methyl-2-buten-1-yl)oxy]phenyl}acrylsäure [German] [ACD/IUPAC Name]
(2E)-3-{3-Fluoro-4-[(3-methyl-2-buten-1-yl)oxy]phenyl}acrylic acid [ACD/IUPAC Name]
2-Propenoic acid, 3-[3-fluoro-4-[(3-methyl-2-buten-1-yl)oxy]phenyl]-, (2E)- [ACD/Index Name]
Acide (2E)-3-{3-fluoro-4-[(3-méthyl-2-butén-1-yl)oxy]phényl}acrylique [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 403.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 197.6±25.9 °C
Index of Refraction: 1.560
Molar Refractivity: 68.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.31
ACD/LogD (pH 5.5): 2.40
ACD/BCF (pH 5.5): 21.25
ACD/KOC (pH 5.5): 150.41
ACD/LogD (pH 7.4): 0.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.39
Polar Surface Area: 47 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 41.0±3.0 dyne/cm
Molar Volume: 212.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement