ChemSpider 2D Image | Dimethyl 5H-5lambda~4~-dibenzo[b,d]thiophen-5-ylidenemalonate | C17H14O4S

Dimethyl 5H-5λ4-dibenzo[b,d]thiophen-5-ylidenemalonate

  • Molecular FormulaC17H14O4S
  • Average mass314.356 Da
  • Monoisotopic mass314.061279 Da
  • ChemSpider ID30651942

More details:

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

5H-5λ4-Dibenzo[b,d]thiophén-5-ylidènemalonate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5H-5λ4-dibenzo[b,d]thiophen-5-ylidenemalonate [ACD/IUPAC Name]
Dimethyl-5H-5λ4-dibenzo[b,d]thiophen-5-ylidenmalonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-(5,5-dihydrodibenzo[b,d]thien-5-ylidene)-, dimethyl ester [ACD/Index 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: 525.4±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±3.0 kJ/mol
Flash Point: 271.6±25.4 °C
Index of Refraction: 1.674
Molar Refractivity: 84.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): 2.70
ACD/BCF (pH 5.5): 66.65
ACD/KOC (pH 5.5): 703.21
ACD/LogD (pH 7.4): 2.70
ACD/BCF (pH 7.4): 66.65
ACD/KOC (pH 7.4): 703.21
Polar Surface Area: 72 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 66.7±5.0 dyne/cm
Molar Volume: 225.2±5.0 cm3

Click to predict properties on the Chemicalize site


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