ChemSpider 2D Image | 4,4,4-Trichloro-2-hydroxybutanal | C4H5Cl3O2

4,4,4-Trichloro-2-hydroxybutanal

  • Molecular FormulaC4H5Cl3O2
  • Average mass191.440 Da
  • Monoisotopic mass189.935516 Da
  • ChemSpider ID24831571

More details:

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

4,4,4-Trichlor-2-hydroxybutanal [German] [ACD/IUPAC Name]
4,4,4-Trichloro-2-hydroxybutanal [ACD/IUPAC Name]
4,4,4-Trichloro-2-hydroxybutanal [French] [ACD/IUPAC Name]
Butanal, 4,4,4-trichloro-2-hydroxy- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 321.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 65.3±6.0 kJ/mol
Flash Point: 148.2±27.9 °C
Index of Refraction: 1.505
Molar Refractivity: 36.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.36
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 15.61
ACD/KOC (pH 5.5): 248.76
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 15.61
ACD/KOC (pH 7.4): 248.76
Polar Surface Area: 37 Å2
Polarizability: 14.6±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 124.0±3.0 cm3

Click to predict properties on the Chemicalize site


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