ChemSpider 2D Image | (4E)-5-(4-Hydroxy-3-methoxyphenyl)-3-oxo-4-pentenoic acid | C12H12O5

(4E)-5-(4-Hydroxy-3-methoxyphenyl)-3-oxo-4-pentenoic acid

  • Molecular FormulaC12H12O5
  • Average mass236.221 Da
  • Monoisotopic mass236.068466 Da
  • ChemSpider ID58163767

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-5-(4-Hydroxy-3-methoxyphenyl)-3-oxo-4-pentenoic acid [ACD/IUPAC Name]
(4E)-5-(4-Hydroxy-3-methoxyphenyl)-3-oxo-4-pentensäure [German] [ACD/IUPAC Name]
4-Pentenoic acid, 5-(4-hydroxy-3-methoxyphenyl)-3-oxo-, (4E)- [ACD/Index Name]
Acide (4E)-5-(4-hydroxy-3-méthoxyphényl)-3-oxo-4-penténoïque [French] [ACD/IUPAC Name]
(4-hydroxy-3-methoxycinnamoyl)acetate
5-(4-hydroxy-3-methoxyphenyl)-3-oxopent-4-enoic acid
feruloylacetic acid

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

Density: 1.3±0.1 g/cm3
Boiling Point: 465.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 182.9±20.8 °C
Index of Refraction: 1.610
Molar Refractivity: 61.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.04
ACD/LogD (pH 5.5): -1.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 57.2±3.0 dyne/cm
Molar Volume: 177.6±3.0 cm3

Click to predict properties on the Chemicalize site


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