ChemSpider 2D Image | 4-(2,4-Dichlorophenyl)-3-(ethoxycarbonyl)-3-butenoic acid | C13H12Cl2O4

4-(2,4-Dichlorophenyl)-3-(ethoxycarbonyl)-3-butenoic acid

  • Molecular FormulaC13H12Cl2O4
  • Average mass303.138 Da
  • Monoisotopic mass302.011261 Da
  • ChemSpider ID24746233

More details:

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

4-(2,4-Dichlorophenyl)-3-(ethoxycarbonyl)-3-butenoic acid [ACD/IUPAC Name]
4-(2,4-Dichlorphenyl)-3-(ethoxycarbonyl)-3-butensäure [German] [ACD/IUPAC Name]
Acide 4-(2,4-dichlorophényl)-3-(éthoxycarbonyl)-3-buténoïque [French] [ACD/IUPAC Name]
Butanedioic acid, 2-[(2,4-dichlorophenyl)methylene]-, 1-ethyl ester [ACD/Index Name]
1180525-97-6 [RN]
2-[1-(2,4-Dichloro-phenyl)-methylidene]-succinic acid 1-ethyl ester

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

Density: 1.4±0.1 g/cm3
Boiling Point: 456.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 229.6±28.7 °C
Index of Refraction: 1.590
Molar Refractivity: 73.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.98
ACD/LogD (pH 5.5): 2.15
ACD/BCF (pH 5.5): 9.94
ACD/KOC (pH 5.5): 59.73
ACD/LogD (pH 7.4): 0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.28
Polar Surface Area: 64 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 51.2±3.0 dyne/cm
Molar Volume: 218.2±3.0 cm3

Click to predict properties on the Chemicalize site


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