ChemSpider 2D Image | 3-(Dodecylsulfanyl)-4-methyl-2,5-furandione | C17H28O3S

3-(Dodecylsulfanyl)-4-methyl-2,5-furandione

  • Molecular FormulaC17H28O3S
  • Average mass312.467 Da
  • Monoisotopic mass312.175903 Da
  • ChemSpider ID57508918

More details:

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

2,5-Furandione, 3-(dodecylthio)-4-methyl- [ACD/Index Name]
3-(Dodecylsulfanyl)-4-methyl-2,5-furandion [German] [ACD/IUPAC Name]
3-(Dodecylsulfanyl)-4-methyl-2,5-furandione [ACD/IUPAC Name]
3-(Dodécylsulfanyl)-4-méthyl-2,5-furanedione [French] [ACD/IUPAC Name]
3-(DODECYLSULFANYL)-4-METHYLFURAN-2,5-DIONE
61192-84-5 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 422.4±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.7±3.0 kJ/mol
Flash Point: 195.2±13.7 °C
Index of Refraction: 1.505
Molar Refractivity: 88.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 6.61
ACD/LogD (pH 5.5): 6.29
ACD/BCF (pH 5.5): 35366.85
ACD/KOC (pH 5.5): 62729.11
ACD/LogD (pH 7.4): 6.29
ACD/BCF (pH 7.4): 35366.85
ACD/KOC (pH 7.4): 62729.11
Polar Surface Area: 69 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 39.5±5.0 dyne/cm
Molar Volume: 297.0±5.0 cm3

Click to predict properties on the Chemicalize site


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