Found 2 results

Search term: KTDRYXACAFZEBC (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-(3-Bromo-4-methoxyphenyl)-1-(4-fluorophenyl)-2-propen-1-one | C16H12BrFO2

3-(3-Bromo-4-methoxyphenyl)-1-(4-fluorophenyl)-2-propen-1-one

  • Molecular FormulaC16H12BrFO2
  • Average mass335.168 Da
  • Monoisotopic mass334.000458 Da
  • ChemSpider ID30637090

More details:

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

2-Propen-1-one, 3-(3-bromo-4-methoxyphenyl)-1-(4-fluorophenyl)- [ACD/Index Name]
3-(3-Brom-4-methoxyphenyl)-1-(4-fluorphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
3-(3-Bromo-4-methoxyphenyl)-1-(4-fluorophenyl)-2-propen-1-one [ACD/IUPAC Name]
3-(3-Bromo-4-méthoxyphényl)-1-(4-fluorophényl)-2-propén-1-one [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 450.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.9±3.0 kJ/mol
Flash Point: 226.2±28.7 °C
Index of Refraction: 1.612
Molar Refractivity: 81.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.81
ACD/LogD (pH 5.5): 4.33
ACD/BCF (pH 5.5): 1145.33
ACD/KOC (pH 5.5): 5384.97
ACD/LogD (pH 7.4): 4.33
ACD/BCF (pH 7.4): 1145.33
ACD/KOC (pH 7.4): 5384.97
Polar Surface Area: 26 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 234.2±3.0 cm3

Click to predict properties on the Chemicalize site


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