ChemSpider 2D Image | 2-({[3-Methoxy-4-(methylsulfonyl)benzyl]sulfanyl}methyl)furan | C14H16O4S2

2-({[3-Methoxy-4-(methylsulfonyl)benzyl]sulfanyl}methyl)furan

  • Molecular FormulaC14H16O4S2
  • Average mass312.404 Da
  • Monoisotopic mass312.049011 Da
  • ChemSpider ID30237171

More details:

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

2-({[3-Methoxy-4-(methylsulfonyl)benzyl]sulfanyl}methyl)furan [German] [ACD/IUPAC Name]
2-({[3-Methoxy-4-(methylsulfonyl)benzyl]sulfanyl}methyl)furan [ACD/IUPAC Name]
2-({[3-Méthoxy-4-(méthylsulfonyl)benzyl]sulfanyl}méthyl)furane [French] [ACD/IUPAC Name]
Furan, 2-[[[[3-methoxy-4-(methylsulfonyl)phenyl]methyl]thio]methyl]- [ACD/Index Name]
2-({[(4-METHANESULFONYL-3-METHOXYPHENYL)METHYL]SULFANYL}METHYL)FURAN

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

Density: 1.3±0.1 g/cm3
Boiling Point: 489.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.7±3.0 kJ/mol
Flash Point: 249.8±28.7 °C
Index of Refraction: 1.574
Molar Refractivity: 81.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 55.60
ACD/KOC (pH 5.5): 617.63
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.60
ACD/KOC (pH 7.4): 617.63
Polar Surface Area: 90 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 245.5±3.0 cm3

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