ChemSpider 2D Image | Methyl 4-(3-{[2-(cyclopentyloxy)-2-oxoethyl]sulfinyl}propoxy)benzoate | C18H24O6S

Methyl 4-(3-{[2-(cyclopentyloxy)-2-oxoethyl]sulfinyl}propoxy)benzoate

  • Molecular FormulaC18H24O6S
  • Average mass368.445 Da
  • Monoisotopic mass368.129364 Da
  • ChemSpider ID60198562

More details:

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

4-(3-{[2-(Cyclopentyloxy)-2-oxoéthyl]sulfinyl}propoxy)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[3-[[2-(cyclopentyloxy)-2-oxoethyl]sulfinyl]propoxy]-, methyl ester [ACD/Index Name]
Methyl 4-(3-{[2-(cyclopentyloxy)-2-oxoethyl]sulfinyl}propoxy)benzoate [ACD/IUPAC Name]
Methyl-4-(3-{[2-(cyclopentyloxy)-2-oxoethyl]sulfinyl}propoxy)benzoat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 562.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.6±3.0 kJ/mol
Flash Point: 294.2±27.3 °C
Index of Refraction: 1.564
Molar Refractivity: 94.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 65.30
ACD/KOC (pH 5.5): 693.00
ACD/LogD (pH 7.4): 2.69
ACD/BCF (pH 7.4): 65.30
ACD/KOC (pH 7.4): 693.00
Polar Surface Area: 98 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 56.2±5.0 dyne/cm
Molar Volume: 290.6±5.0 cm3

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