ChemSpider 2D Image | 4-Bromo-2,2-dimethyl-8-phenoxy-3-octanone | C16H23BrO2

4-Bromo-2,2-dimethyl-8-phenoxy-3-octanone

  • Molecular FormulaC16H23BrO2
  • Average mass327.257 Da
  • Monoisotopic mass326.088135 Da
  • ChemSpider ID28715001

More details:

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

3-Octanone, 4-bromo-2,2-dimethyl-8-phenoxy- [ACD/Index Name]
4-Brom-2,2-dimethyl-8-phenoxy-3-octanon [German] [ACD/IUPAC Name]
4-Bromo-2,2-dimethyl-8-phenoxy-3-octanone [ACD/IUPAC Name]
4-Bromo-2,2-diméthyl-8-phénoxy-3-octanone [French] [ACD/IUPAC Name]
100219-26-9 [RN]
4-Bromo-2,2-dimethyl-8-phenoxyoctan-3-one

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

Density: 1.2±0.1 g/cm3
Boiling Point: 423.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.8±3.0 kJ/mol
Flash Point: 209.9±25.9 °C
Index of Refraction: 1.516
Molar Refractivity: 82.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.56
ACD/LogD (pH 5.5): 4.35
ACD/BCF (pH 5.5): 1185.10
ACD/KOC (pH 5.5): 5518.14
ACD/LogD (pH 7.4): 4.35
ACD/BCF (pH 7.4): 1185.10
ACD/KOC (pH 7.4): 5518.14
Polar Surface Area: 26 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 36.8±3.0 dyne/cm
Molar Volume: 272.7±3.0 cm3

Click to predict properties on the Chemicalize site


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