ChemSpider 2D Image | (3-Formyl-2,4-diiodophenyl)acetonitrile | C9H5I2NO

(3-Formyl-2,4-diiodophenyl)acetonitrile

  • Molecular FormulaC9H5I2NO
  • Average mass396.951 Da
  • Monoisotopic mass396.846039 Da
  • ChemSpider ID111944753

More details:

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

(3-Formyl-2,4-diiodophenyl)acetonitrile [ACD/IUPAC Name]
(3-Formyl-2,4-diiodophényl)acétonitrile [French] [ACD/IUPAC Name]
(3-Formyl-2,4-diiodphenyl)acetonitril [German] [ACD/IUPAC Name]
Benzeneacetonitrile, 3-formyl-2,4-diiodo- [ACD/Index Name]

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

Density: 2.3±0.1 g/cm3
Boiling Point: 433.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.9±3.0 kJ/mol
Flash Point: 215.8±28.7 °C
Index of Refraction: 1.728
Molar Refractivity: 68.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.67
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 106.54
ACD/KOC (pH 5.5): 983.83
ACD/LogD (pH 7.4): 2.97
ACD/BCF (pH 7.4): 106.54
ACD/KOC (pH 7.4): 983.83
Polar Surface Area: 41 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 65.9±3.0 dyne/cm
Molar Volume: 171.4±3.0 cm3

Click to predict properties on the Chemicalize site


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