ChemSpider 2D Image | 2-(Methylsulfanyl)ethyl [(2-methyl-2-propanyl)sulfanyl]acetate | C9H18O2S2

2-(Methylsulfanyl)ethyl [(2-methyl-2-propanyl)sulfanyl]acetate

  • Molecular FormulaC9H18O2S2
  • Average mass222.368 Da
  • Monoisotopic mass222.074814 Da
  • ChemSpider ID31292400

More details:

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

[(2-Méthyl-2-propanyl)sulfanyl]acétate de 2-(méthylsulfanyl)éthyle [French] [ACD/IUPAC Name]
2-(Methylsulfanyl)ethyl [(2-methyl-2-propanyl)sulfanyl]acetate [ACD/IUPAC Name]
2-(Methylsulfanyl)ethyl-[(2-methyl-2-propanyl)sulfanyl]acetat [German] [ACD/IUPAC Name]
Acetic acid, 2-[(1,1-dimethylethyl)thio]-, 2-(methylthio)ethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 302.6±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.3±3.0 kJ/mol
Flash Point: 133.5±11.7 °C
Index of Refraction: 1.501
Molar Refractivity: 61.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 172.32
ACD/KOC (pH 5.5): 1387.94
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 172.32
ACD/KOC (pH 7.4): 1387.94
Polar Surface Area: 77 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 36.1±3.0 dyne/cm
Molar Volume: 208.6±3.0 cm3

Click to predict properties on the Chemicalize site


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