ChemSpider 2D Image | (2Z,4E)-4-carboxy-2-hydroxyhexa-2,4-dienedioic acid | C7H6O7

(2Z,4E)-4-carboxy-2-hydroxyhexa-2,4-dienedioic acid

  • Molecular FormulaC7H6O7
  • Average mass202.118 Da
  • Monoisotopic mass202.011353 Da
  • ChemSpider ID26332241

  • Double-bond stereo - Double-bond stereo

More details:

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

(1E,3Z)-4-Hydroxy-1,3-butadien-1,2,4-tricarbonsäure [German] [ACD/IUPAC Name]
(1E,3Z)-4-Hydroxy-1,3-butadiene-1,2,4-tricarboxylic acid [ACD/IUPAC Name]
(2Z,4E)-4-carboxy-2-hydroxyhexa-2,4-dienedioic acid
1,3-Butadiene-1,2,4-tricarboxylic acid, 4-hydroxy-, (1E,3Z)- [ACD/Index Name]
Acide (1E,3Z)-4-hydroxy-1,3-butadiène-1,2,4-tricarboxylique [French] [ACD/IUPAC Name]
(1E,3Z)-4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acid
(E,Z)-4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acid
(Z,E)-4-carboxy-2-hydroxyhexa-2,4-dienedioic acid
0GY
  • Miscellaneous

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

Density: 1.8±0.1 g/cm3
Boiling Point: 411.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.7±6.0 kJ/mol
Flash Point: 216.9±25.2 °C
Index of Refraction: 1.641
Molar Refractivity: 40.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.75
ACD/LogD (pH 5.5): -5.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 105.1±3.0 dyne/cm
Molar Volume: 112.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement