ChemSpider 2D Image | 1-(3-Iodopropyl)-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane | C9H15IO3

1-(3-Iodopropyl)-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane

  • Molecular FormulaC9H15IO3
  • Average mass298.118 Da
  • Monoisotopic mass298.006592 Da
  • ChemSpider ID57475529

More details:

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

1-(3-Iodopropyl)-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane [ACD/IUPAC Name]
1-(3-Iodopropyl)-4-méthyl-2,6,7-trioxabicyclo[2.2.2]octane [French] [ACD/IUPAC Name]
1-(3-Iodpropyl)-4-methyl-2,6,7-trioxabicyclo[2.2.2]octan [German] [ACD/IUPAC Name]
2,6,7-Trioxabicyclo[2.2.2]octane, 1-(3-iodopropyl)-4-methyl- [ACD/Index Name]
74900-28-0 [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: 284.8±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.3±3.0 kJ/mol
Flash Point: 126.1±21.8 °C
Index of Refraction: 1.556
Molar Refractivity: 57.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.38
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 20.12
ACD/KOC (pH 5.5): 298.33
ACD/LogD (pH 7.4): 2.02
ACD/BCF (pH 7.4): 20.12
ACD/KOC (pH 7.4): 298.33
Polar Surface Area: 28 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 55.0±3.0 dyne/cm
Molar Volume: 178.5±3.0 cm3

Click to predict properties on the Chemicalize site


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