ChemSpider 2D Image | 1-(2-Methyl-2-propanyl)-4-{[(3-phenylpropyl)sulfonyl]methyl}benzene | C20H26O2S

1-(2-Methyl-2-propanyl)-4-{[(3-phenylpropyl)sulfonyl]methyl}benzene

  • Molecular FormulaC20H26O2S
  • Average mass330.484 Da
  • Monoisotopic mass330.165344 Da
  • ChemSpider ID31546882

More details:

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

1-(2-Methyl-2-propanyl)-4-{[(3-phenylpropyl)sulfonyl]methyl}benzene [ACD/IUPAC Name]
1-(2-Méthyl-2-propanyl)-4-{[(3-phénylpropyl)sulfonyl]méthyl}benzène [French] [ACD/IUPAC Name]
1-(2-Methyl-2-propanyl)-4-{[(3-phenylpropyl)sulfonyl]methyl}benzol [German] [ACD/IUPAC Name]
Benzene, 1-(1,1-dimethylethyl)-4-[[(3-phenylpropyl)sulfonyl]methyl]- [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: 503.9±39.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 302.0±19.7 °C
Index of Refraction: 1.554
Molar Refractivity: 97.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.05
ACD/LogD (pH 5.5): 4.71
ACD/BCF (pH 5.5): 2245.34
ACD/KOC (pH 5.5): 8718.54
ACD/LogD (pH 7.4): 4.71
ACD/BCF (pH 7.4): 2245.34
ACD/KOC (pH 7.4): 8718.54
Polar Surface Area: 43 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 40.6±3.0 dyne/cm
Molar Volume: 303.7±3.0 cm3

Click to predict properties on the Chemicalize site


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