ChemSpider 2D Image | 4-(Hydroxyimino)-3-iodo-2,5-cyclohexadien-1-one | C6H4INO2

4-(Hydroxyimino)-3-iodo-2,5-cyclohexadien-1-one

  • Molecular FormulaC6H4INO2
  • Average mass249.006 Da
  • Monoisotopic mass248.928665 Da
  • ChemSpider ID21247748

More details:

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

2,5-Cyclohexadiene-1,4-dione, 2-iodo-, 1-oxime [ACD/Index Name]
4-(Hydroxyimino)-3-iod-2,5-cyclohexadien-1-on [German] [ACD/IUPAC Name]
4-(Hydroxyimino)-3-iodo-2,5-cyclohexadien-1-one [ACD/IUPAC Name]
4-(Hydroxyimino)-3-iodo-2,5-cyclohexadién-1-one [French] [ACD/IUPAC Name]
4-(Hydroxyimino)-3-iodocyclohexa-2,5-dien-1-one
2,5-Cyclohexadien-1-one, 4-hydroxyimino-3-iodo-
39495-50-6 [RN]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 319.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 65.0±6.0 kJ/mol
Flash Point: 146.8±27.9 °C
Index of Refraction: 1.694
Molar Refractivity: 45.1±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.93
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 4.15
ACD/KOC (pH 5.5): 73.01
ACD/LogD (pH 7.4): -0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.52
Polar Surface Area: 50 Å2
Polarizability: 17.9±0.5 10-24cm3
Surface Tension: 58.9±7.0 dyne/cm
Molar Volume: 117.3±7.0 cm3

Click to predict properties on the Chemicalize site


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