ChemSpider 2D Image | (2E)-2,3,5-Trihydroxy-4-oxo-2-pentenoic acid | C5H6O6

(2E)-2,3,5-Trihydroxy-4-oxo-2-pentenoic acid

  • Molecular FormulaC5H6O6
  • Average mass162.098 Da
  • Monoisotopic mass162.016434 Da
  • ChemSpider ID60746447

More details:

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

(2E)-2,3,5-Trihydroxy-4-oxo-2-pentenoic acid [ACD/IUPAC Name]
(2E)-2,3,5-Trihydroxy-4-oxo-2-pentensäure [German] [ACD/IUPAC Name]
2-Pentenoic acid, 2,3,5-trihydroxy-4-oxo-, (2E)- [ACD/Index Name]
Acide (2E)-2,3,5-trihydroxy-4-oxo-2-penténoïque [French] [ACD/IUPAC Name]
1379406-68-4 [RN]
MFCD20654007

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

Density: 1.8±0.1 g/cm3
Boiling Point: 423.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±6.0 kJ/mol
Flash Point: 224.2±25.2 °C
Index of Refraction: 1.621
Molar Refractivity: 31.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.20
ACD/LogD (pH 5.5): -4.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 115 Å2
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 111.4±3.0 dyne/cm
Molar Volume: 88.6±3.0 cm3

Click to predict properties on the Chemicalize site


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