ChemSpider 2D Image | 3-Iodo-1-propene-1,1-diol | C3H5IO2

3-Iodo-1-propene-1,1-diol

  • Molecular FormulaC3H5IO2
  • Average mass199.975 Da
  • Monoisotopic mass199.933411 Da
  • ChemSpider ID95702783

More details:

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

1-Propene-1,1-diol, 3-iodo- [ACD/Index Name]
3-Iod-1-propen-1,1-diol [German] [ACD/IUPAC Name]
3-Iodo-1-propene-1,1-diol [ACD/IUPAC Name]
3-Iodo-1-propène-1,1-diol [French] [ACD/IUPAC 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: 306.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 63.5±6.0 kJ/mol
Flash Point: 139.3±27.9 °C
Index of Refraction: 1.671
Molar Refractivity: 31.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.65
ACD/LogD (pH 5.5): 0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 25.93
ACD/LogD (pH 7.4): 0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 25.49
Polar Surface Area: 40 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 65.1±3.0 dyne/cm
Molar Volume: 85.3±3.0 cm3

Click to predict properties on the Chemicalize site


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