ChemSpider 2D Image | (2Z,4E)-(~2~H_4_)-2,4-Hexadienedioic acid | C6H2D4O4

(2Z,4E)-(2H4)-2,4-Hexadienedioic acid

  • Molecular FormulaC6H2D4O4
  • Average mass146.134 Da
  • Monoisotopic mass146.051712 Da
  • ChemSpider ID77450861

  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope

More details:

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

(2Z,4E)-(2H4)-2,4-Hexadiendisäure [German] [ACD/IUPAC Name]
(2Z,4E)-(2H4)-2,4-Hexadienedioic acid [ACD/IUPAC Name]
2,4-Hexadienedioic-2,3,4,5-d4 acid, (2Z,4E)- [ACD/Index Name]
Acide (2Z,4E)-(2H4)-2,4-hexadiènedioïque [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 345.4±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 64.8±6.0 kJ/mol
Flash Point: 176.9±16.9 °C
Index of Refraction: 1.549
Molar Refractivity: 33.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.21
ACD/LogD (pH 5.5): -2.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 75 Å2
Polarizability: 13.1±0.5 10-24cm3
Surface Tension: 59.4±3.0 dyne/cm
Molar Volume: 104.1±3.0 cm3

Click to predict properties on the Chemicalize site


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