ChemSpider 2D Image | 3-(3-Bromopropoxy)-2-cyclohexen-1-one | C9H13BrO2

3-(3-Bromopropoxy)-2-cyclohexen-1-one

  • Molecular FormulaC9H13BrO2
  • Average mass233.102 Da
  • Monoisotopic mass232.009888 Da
  • ChemSpider ID71095796

More details:

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

2-Cyclohexen-1-one, 3-(3-bromopropoxy)- [ACD/Index Name]
3-(3-Bromopropoxy)-2-cyclohexen-1-one [ACD/IUPAC Name]
3-(3-Bromopropoxy)-2-cyclohexén-1-one [French] [ACD/IUPAC Name]
3-(3-Brompropoxy)-2-cyclohexen-1-on [German] [ACD/IUPAC Name]
2248280-43-3 [RN]
3-(3-bromopropoxy)cyclohex-2-en-1-one
MFCD31719111

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

Density: 1.4±0.1 g/cm3
Boiling Point: 331.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.4±3.0 kJ/mol
Flash Point: 154.5±27.9 °C
Index of Refraction: 1.515
Molar Refractivity: 50.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.68
ACD/LogD (pH 5.5): 2.17
ACD/BCF (pH 5.5): 26.19
ACD/KOC (pH 5.5): 360.36
ACD/LogD (pH 7.4): 2.17
ACD/BCF (pH 7.4): 26.19
ACD/KOC (pH 7.4): 360.36
Polar Surface Area: 26 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 39.4±5.0 dyne/cm
Molar Volume: 168.9±5.0 cm3

Click to predict properties on the Chemicalize site


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