ChemSpider 2D Image | Methyl (2Z)-4-(2,5-dimethoxyphenyl)-2-hydroxy-4-oxo-2-butenoate | C13H14O6

Methyl (2Z)-4-(2,5-dimethoxyphenyl)-2-hydroxy-4-oxo-2-butenoate

  • Molecular FormulaC13H14O6
  • Average mass266.247 Da
  • Monoisotopic mass266.079041 Da
  • ChemSpider ID21788036

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-4-(2,5-Diméthoxyphényl)-2-hydroxy-4-oxo-2-buténoate de méthyle [French] [ACD/IUPAC Name]
2-Butenoic acid, 4-(2,5-dimethoxyphenyl)-2-hydroxy-4-oxo-, methyl ester, (2Z)- [ACD/Index Name]
Methyl (2Z)-4-(2,5-dimethoxyphenyl)-2-hydroxy-4-oxo-2-butenoate [ACD/IUPAC Name]
Methyl-(2Z)-4-(2,5-dimethoxyphenyl)-2-hydroxy-4-oxo-2-butenoat [German] [ACD/IUPAC Name]
methyl (2Z)-4-(2,5-dimethoxyphenyl)-2-hydroxy-4-oxobut-2-enoate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 444.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.1±3.0 kJ/mol
Flash Point: 168.7±22.2 °C
Index of Refraction: 1.540
Molar Refractivity: 66.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.03
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 3.00
ACD/KOC (pH 5.5): 76.34
ACD/LogD (pH 7.4): 0.85
ACD/BCF (pH 7.4): 2.47
ACD/KOC (pH 7.4): 62.96
Polar Surface Area: 82 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 212.9±3.0 cm3

Click to predict properties on the Chemicalize site


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