ChemSpider 2D Image | Ethyl 6-[4-(methylsulfonyl)phenoxy]hexanoate | C15H22O5S

Ethyl 6-[4-(methylsulfonyl)phenoxy]hexanoate

  • Molecular FormulaC15H22O5S
  • Average mass314.397 Da
  • Monoisotopic mass314.118805 Da
  • ChemSpider ID32677488

More details:

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

6-[4-(Méthylsulfonyl)phénoxy]hexanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 6-[4-(methylsulfonyl)phenoxy]hexanoate [ACD/IUPAC Name]
Ethyl-6-[4-(methylsulfonyl)phenoxy]hexanoat [German] [ACD/IUPAC Name]
Hexanoic acid, 6-[4-(methylsulfonyl)phenoxy]-, ethyl ester [ACD/Index Name]
1054521-60-6 [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: 465.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.8±3.0 kJ/mol
Flash Point: 235.5±28.7 °C
Index of Refraction: 1.501
Molar Refractivity: 80.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.30
ACD/LogD (pH 5.5): 2.32
ACD/BCF (pH 5.5): 34.12
ACD/KOC (pH 5.5): 435.48
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 34.12
ACD/KOC (pH 7.4): 435.48
Polar Surface Area: 78 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 39.6±3.0 dyne/cm
Molar Volume: 274.2±3.0 cm3

Click to predict properties on the Chemicalize site


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