ChemSpider 2D Image | 2,2,2-Trichloro-1,1-ethane(~2~H_2_)diol | C2HD2Cl3O2

2,2,2-Trichloro-1,1-ethane(2H2)diol

  • Molecular FormulaC2HD2Cl3O2
  • Average mass167.415 Da
  • Monoisotopic mass165.932419 Da
  • ChemSpider ID62777967

  • Non-standard isotope - Non-standard isotope

More details:

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

1,1-Ethanediol-d2, 2,2,2-trichloro- [ACD/Index Name]
2,2,2-Trichlor-1,1-ethan(2H2)diol [German] [ACD/IUPAC Name]
2,2,2-Trichloro-1,1-ethane(2H2)diol [ACD/IUPAC Name]
2,2,2-Trichloro-1,1-éthane(2H2)diol [French] [ACD/IUPAC Name]
19220-07-6 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 96.3±0.0 °C at 760 mmHg
Vapour Pressure: 25.6±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.2±6.0 kJ/mol
Flash Point: 57.3±25.9 °C
Index of Refraction: 1.546
Molar Refractivity: 28.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.27
ACD/LogD (pH 5.5): 0.79
ACD/BCF (pH 5.5): 2.33
ACD/KOC (pH 5.5): 63.68
ACD/LogD (pH 7.4): 0.79
ACD/BCF (pH 7.4): 2.32
ACD/KOC (pH 7.4): 63.64
Polar Surface Area: 40 Å2
Polarizability: 11.4±0.5 10-24cm3
Surface Tension: 59.4±3.0 dyne/cm
Molar Volume: 91.1±3.0 cm3

Click to predict properties on the Chemicalize site


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