ChemSpider 2D Image | 4,4-Dichloro-2-oxo-3-butenoic acid | C4H2Cl2O3

4,4-Dichloro-2-oxo-3-butenoic acid

  • Molecular FormulaC4H2Cl2O3
  • Average mass168.963 Da
  • Monoisotopic mass167.938095 Da
  • ChemSpider ID60746788

More details:

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

3-Butenoic acid, 4,4-dichloro-2-oxo- [ACD/Index Name]
4,4-Dichlor-2-oxo-3-butensäure [German] [ACD/IUPAC Name]
4,4-Dichloro-2-oxo-3-butenoic acid [ACD/IUPAC Name]
Acide 4,4-dichloro-2-oxo-3-buténoïque [French] [ACD/IUPAC Name]
16493-88-2 [RN]
MFCD20644027

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

Density: 1.6±0.1 g/cm3
Boiling Point: 201.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.8 mmHg at 25°C
Enthalpy of Vaporization: 48.2±6.0 kJ/mol
Flash Point: 75.5±27.3 °C
Index of Refraction: 1.532
Molar Refractivity: 31.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.01
ACD/LogD (pH 5.5): -2.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 54 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 102.5±3.0 cm3

Click to predict properties on the Chemicalize site


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