ChemSpider 2D Image | (2E)-3,3'-(1,4-Phenylene)bis[1-(2-thienyl)-2-propen-1-one] | C20H14O2S2

(2E)-3,3'-(1,4-Phenylene)bis[1-(2-thienyl)-2-propen-1-one]

  • Molecular FormulaC20H14O2S2
  • Average mass350.454 Da
  • Monoisotopic mass350.043518 Da
  • ChemSpider ID57581754

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3,3'-(1,4-Phenylen)bis[1-(2-thienyl)-2-propen-1-on] [German] [ACD/IUPAC Name]
(2E)-3,3'-(1,4-Phenylene)bis[1-(2-thienyl)-2-propen-1-one] [ACD/IUPAC Name]
(2E)-3,3'-(1,4-Phénylène)bis[1-(2-thiényl)-2-propén-1-one] [French] [ACD/IUPAC Name]
2-Propen-1-one, 3,3'-(1,4-phenylene)bis[1-(2-thienyl)-, (2E)- [ACD/Index Name]
26473-83-6 [RN]
2-PROPEN-1-ONE, 3,3'-(1,4-PHENYLENE)BIS[1-(2-THIENYL)- [ACD/Index Name]
3,3'-(1,4-Phenylene)bis[1-(2-thienyl)-2-propen-1-one] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 554.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.5±3.0 kJ/mol
Flash Point: 289.0±30.1 °C
Index of Refraction: 1.706
Molar Refractivity: 104.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 4.68
ACD/BCF (pH 5.5): 2128.88
ACD/KOC (pH 5.5): 8392.42
ACD/LogD (pH 7.4): 4.68
ACD/BCF (pH 7.4): 2128.88
ACD/KOC (pH 7.4): 8392.42
Polar Surface Area: 91 Å2
Polarizability: 41.5±0.5 10-24cm3
Surface Tension: 57.4±3.0 dyne/cm
Molar Volume: 269.2±3.0 cm3

Click to predict properties on the Chemicalize site


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