ChemSpider 2D Image | 5-Ethoxy-1,3-dimethyl-2-(methylsulfanyl)benzene | C11H16OS

5-Ethoxy-1,3-dimethyl-2-(methylsulfanyl)benzene

  • Molecular FormulaC11H16OS
  • Average mass196.309 Da
  • Monoisotopic mass196.092178 Da
  • ChemSpider ID35330992

More details:

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

5-Ethoxy-1,3-dimethyl-2-(methylsulfanyl)benzene [ACD/IUPAC Name]
5-Éthoxy-1,3-diméthyl-2-(méthylsulfanyl)benzène [French] [ACD/IUPAC Name]
5-Ethoxy-1,3-dimethyl-2-(methylsulfanyl)benzol [German] [ACD/IUPAC Name]
Benzene, 5-ethoxy-1,3-dimethyl-2-(methylthio)- [ACD/Index Name]
(4-Ethoxy-2,6-dimethylphenyl)(methyl)sulfane
1280112-61-9 [RN]
2,6-Dimethyl-4-ethoxyphenyl methyl sulfide
atoms 13 bonds 13
MFCD18375529

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

Density: 1.0±0.1 g/cm3
Boiling Point: 275.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.3±3.0 kJ/mol
Flash Point: 120.4±27.3 °C
Index of Refraction: 1.536
Molar Refractivity: 59.6±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.53
ACD/LogD (pH 5.5): 4.15
ACD/BCF (pH 5.5): 843.09
ACD/KOC (pH 5.5): 4324.55
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 843.09
ACD/KOC (pH 7.4): 4324.55
Polar Surface Area: 35 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 36.9±5.0 dyne/cm
Molar Volume: 191.3±5.0 cm3

Click to predict properties on the Chemicalize site


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