ChemSpider 2D Image | 2-Iodo-1,3,5-cycloheptatriene | C7H7I

2-Iodo-1,3,5-cycloheptatriene

  • Molecular FormulaC7H7I
  • Average mass218.035 Da
  • Monoisotopic mass217.959229 Da
  • ChemSpider ID62818916

More details:

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

1,3,5-Cycloheptatriene, 2-iodo- [ACD/Index Name]
2-Iod-1,3,5-cycloheptatrien [German] [ACD/IUPAC Name]
2-Iodo-1,3,5-cycloheptatriene [ACD/IUPAC Name]
2-Iodo-1,3,5-cycloheptatriène [French] [ACD/IUPAC Name]
827598-91-4 [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: 228.1±20.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.6±3.0 kJ/mol
Flash Point: 105.3±16.1 °C
Index of Refraction: 1.634
Molar Refractivity: 44.8±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 123.73
ACD/KOC (pH 5.5): 1094.96
ACD/LogD (pH 7.4): 3.06
ACD/BCF (pH 7.4): 123.73
ACD/KOC (pH 7.4): 1094.96
Polar Surface Area: 0 Å2
Polarizability: 17.8±0.5 10-24cm3
Surface Tension: 40.2±5.0 dyne/cm
Molar Volume: 125.4±5.0 cm3

Click to predict properties on the Chemicalize site


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