ChemSpider 2D Image | (3Z)-1,3,5-Hexatriene-1,6-dione | C6H4O2

(3Z)-1,3,5-Hexatriene-1,6-dione

  • Molecular FormulaC6H4O2
  • Average mass108.095 Da
  • Monoisotopic mass108.021126 Da
  • ChemSpider ID74014212

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-1,3,5-Hexatrien-1,6-dion [German] [ACD/IUPAC Name]
(3Z)-1,3,5-Hexatriene-1,6-dione [ACD/IUPAC Name]
(3Z)-1,3,5-Hexatriène-1,6-dione [French] [ACD/IUPAC Name]
1,3,5-Hexatriene-1,6-dione, (3Z)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 118.9±10.0 °C at 760 mmHg
Vapour Pressure: 16.4±0.2 mmHg at 25°C
Enthalpy of Vaporization: 35.7±3.0 kJ/mol
Flash Point: 22.5±14.0 °C
Index of Refraction: 1.447
Molar Refractivity: 30.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.00
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.77
ACD/LogD (pH 7.4): 0.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 28.77
Polar Surface Area: 34 Å2
Polarizability: 12.0±0.5 10-24cm3
Surface Tension: 8.4±3.0 dyne/cm
Molar Volume: 113.1±3.0 cm3

Click to predict properties on the Chemicalize site


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