ChemSpider 2D Image | 1-Methyl-2-{[(3-phenylpropyl)sulfinyl]methyl}benzene | C17H20OS

1-Methyl-2-{[(3-phenylpropyl)sulfinyl]methyl}benzene

  • Molecular FormulaC17H20OS
  • Average mass272.405 Da
  • Monoisotopic mass272.123474 Da
  • ChemSpider ID60210180

More details:

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

1-Methyl-2-{[(3-phenylpropyl)sulfinyl]methyl}benzene [ACD/IUPAC Name]
1-Méthyl-2-{[(3-phénylpropyl)sulfinyl]méthyl}benzène [French] [ACD/IUPAC Name]
1-Methyl-2-{[(3-phenylpropyl)sulfinyl]methyl}benzol [German] [ACD/IUPAC Name]
Benzene, 1-methyl-2-[[(3-phenylpropyl)sulfinyl]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: 477.1±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.3±3.0 kJ/mol
Flash Point: 242.3±25.7 °C
Index of Refraction: 1.605
Molar Refractivity: 83.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.44
ACD/LogD (pH 5.5): 3.68
ACD/BCF (pH 5.5): 367.59
ACD/KOC (pH 5.5): 2387.21
ACD/LogD (pH 7.4): 3.68
ACD/BCF (pH 7.4): 367.59
ACD/KOC (pH 7.4): 2387.21
Polar Surface Area: 36 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 241.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement