ChemSpider 2D Image | Methyl 2-{[2-(ethylsulfanyl)ethyl]sulfanyl}propanoate | C8H16O2S2

Methyl 2-{[2-(ethylsulfanyl)ethyl]sulfanyl}propanoate

  • Molecular FormulaC8H16O2S2
  • Average mass208.341 Da
  • Monoisotopic mass208.059174 Da
  • ChemSpider ID30117956

More details:

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

2-{[2-(Éthylsulfanyl)éthyl]sulfanyl}propanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 2-{[2-(ethylsulfanyl)ethyl]sulfanyl}propanoate [ACD/IUPAC Name]
Methyl-2-{[2-(ethylsulfanyl)ethyl]sulfanyl}propanoat [German] [ACD/IUPAC Name]
Propanoic acid, 2-[[2-(ethylthio)ethyl]thio]-, methyl ester [ACD/Index Name]
1797942-44-9 [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: 285.9±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.5±3.0 kJ/mol
Flash Point: 125.9±9.8 °C
Index of Refraction: 1.503
Molar Refractivity: 56.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.73
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 77.39
ACD/KOC (pH 5.5): 782.58
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 77.39
ACD/KOC (pH 7.4): 782.58
Polar Surface Area: 77 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 36.8±3.0 dyne/cm
Molar Volume: 192.4±3.0 cm3

Click to predict properties on the Chemicalize site


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