ChemSpider 2D Image | 2-Bromo-1-phenyl-2-[4-(2,4,4-trimethyl-2-pentanyl)phenoxy]ethanone | C22H27BrO2

2-Bromo-1-phenyl-2-[4-(2,4,4-trimethyl-2-pentanyl)phenoxy]ethanone

  • Molecular FormulaC22H27BrO2
  • Average mass403.353 Da
  • Monoisotopic mass402.119446 Da
  • ChemSpider ID73969111

More details:

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

2-Brom-1-phenyl-2-[4-(2,4,4-trimethyl-2-pentanyl)phenoxy]ethanon [German] [ACD/IUPAC Name]
2-Bromo-1-phenyl-2-[4-(2,4,4-trimethyl-2-pentanyl)phenoxy]ethanone [ACD/IUPAC Name]
2-Bromo-1-phényl-2-[4-(2,4,4-triméthyl-2-pentanyl)phénoxy]éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-bromo-1-phenyl-2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]- [ACD/Index 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: 470.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.4±3.0 kJ/mol
Flash Point: 238.6±28.7 °C
Index of Refraction: 1.551
Molar Refractivity: 107.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 7.53
ACD/LogD (pH 5.5): 6.67
ACD/BCF (pH 5.5): 68695.74
ACD/KOC (pH 5.5): 100891.54
ACD/LogD (pH 7.4): 6.67
ACD/BCF (pH 7.4): 68695.74
ACD/KOC (pH 7.4): 100891.54
Polar Surface Area: 26 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 335.7±3.0 cm3

Click to predict properties on the Chemicalize site


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