ChemSpider 2D Image | Methyl 4-[3-(nonylsulfinyl)propoxy]benzoate | C20H32O4S

Methyl 4-[3-(nonylsulfinyl)propoxy]benzoate

  • Molecular FormulaC20H32O4S
  • Average mass368.531 Da
  • Monoisotopic mass368.202118 Da
  • ChemSpider ID60198620

More details:

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

4-[3-(Nonylsulfinyl)propoxy]benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[3-(nonylsulfinyl)propoxy]-, methyl ester [ACD/Index Name]
Methyl 4-[3-(nonylsulfinyl)propoxy]benzoate [ACD/IUPAC Name]
Methyl-4-[3-(nonylsulfinyl)propoxy]benzoat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 534.9±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.1±3.0 kJ/mol
Flash Point: 277.3±24.6 °C
Index of Refraction: 1.523
Molar Refractivity: 104.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 5.70
ACD/BCF (pH 5.5): 12575.82
ACD/KOC (pH 5.5): 29925.16
ACD/LogD (pH 7.4): 5.70
ACD/BCF (pH 7.4): 12575.82
ACD/KOC (pH 7.4): 29925.16
Polar Surface Area: 72 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 43.1±3.0 dyne/cm
Molar Volume: 342.4±3.0 cm3

Click to predict properties on the Chemicalize site


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