ChemSpider 2D Image | (2Z)-3-(3-Bromo-5-fluorophenyl)-2-fluoroacrylic acid | C9H5BrF2O2

(2Z)-3-(3-Bromo-5-fluorophenyl)-2-fluoroacrylic acid

  • Molecular FormulaC9H5BrF2O2
  • Average mass263.036 Da
  • Monoisotopic mass261.944092 Da
  • ChemSpider ID61364978

More details:

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

(2Z)-3-(3-Brom-5-fluorphenyl)-2-fluoracrylsäure [German] [ACD/IUPAC Name]
(2Z)-3-(3-Bromo-5-fluorophenyl)-2-fluoroacrylic acid [ACD/IUPAC Name]
2-Propenoic acid, 3-(3-bromo-5-fluorophenyl)-2-fluoro-, (2Z)- [ACD/Index Name]
Acide (2Z)-3-(3-bromo-5-fluorophényl)-2-fluoroacrylique [French] [ACD/IUPAC Name]
1937220-36-4 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 342.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.8±3.0 kJ/mol
Flash Point: 160.8±27.9 °C
Index of Refraction: 1.598
Molar Refractivity: 51.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.25
ACD/LogD (pH 5.5): -0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 47.4±3.0 dyne/cm
Molar Volume: 150.7±3.0 cm3

Click to predict properties on the Chemicalize site


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