ChemSpider 2D Image | (2Z)-3-Oxo-2-(2-thienylmethylene)-2,3-dihydro-1-benzofuran-6-yl (2E)-3-(2-thienyl)acrylate | C20H12O4S2

(2Z)-3-Oxo-2-(2-thienylmethylene)-2,3-dihydro-1-benzofuran-6-yl (2E)-3-(2-thienyl)acrylate

  • Molecular FormulaC20H12O4S2
  • Average mass380.437 Da
  • Monoisotopic mass380.017700 Da
  • ChemSpider ID124405826

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(2-Thiényl)acrylate de (2Z)-3-oxo-2-(2-thiénylméthylène)-2,3-dihydro-1-benzofuran-6-yle [French] [ACD/IUPAC Name]
(2Z)-3-Oxo-2-(2-thienylmethylen)-2,3-dihydro-1-benzofuran-6-yl-(2E)-3-(2-thienyl)acrylat [German] [ACD/IUPAC Name]
(2Z)-3-Oxo-2-(2-thienylmethylene)-2,3-dihydro-1-benzofuran-6-yl (2E)-3-(2-thienyl)acrylate [ACD/IUPAC Name]
2-Propenoic acid, 3-(2-thienyl)-, (2Z)-2,3-dihydro-3-oxo-2-(2-thienylmethylene)-6-benzofuranyl ester, (2E)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 603.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.7±3.0 kJ/mol
Flash Point: 318.5±31.5 °C
Index of Refraction: 1.745
Molar Refractivity: 105.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 4.49
ACD/BCF (pH 5.5): 1534.76
ACD/KOC (pH 5.5): 6639.96
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1534.76
ACD/KOC (pH 7.4): 6639.96
Polar Surface Area: 109 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 70.3±3.0 dyne/cm
Molar Volume: 259.3±3.0 cm3

Click to predict properties on the Chemicalize site


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