ChemSpider 2D Image | 3-[(2-Naphthylsulfanyl)methyl]-4-phenyl-5,6-dihydro-2H-pyran-2-one | C22H18O2S

3-[(2-Naphthylsulfanyl)methyl]-4-phenyl-5,6-dihydro-2H-pyran-2-one

  • Molecular FormulaC22H18O2S
  • Average mass346.442 Da
  • Monoisotopic mass346.102753 Da
  • ChemSpider ID21159273

More details:

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

2H-Pyran-2-one, 5,6-dihydro-3-[(2-naphthalenylthio)methyl]-4-phenyl- [ACD/Index Name]
3-[(2-Naphthylsulfanyl)methyl]-4-phenyl-5,6-dihydro-2H-pyran-2-on [German] [ACD/IUPAC Name]
3-[(2-Naphthylsulfanyl)methyl]-4-phenyl-5,6-dihydro-2H-pyran-2-one [ACD/IUPAC Name]
3-[(2-Naphtylsulfanyl)méthyl]-4-phényl-5,6-dihydro-2H-pyran-2-one [French] [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: 568.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.3±3.0 kJ/mol
Flash Point: 294.0±18.1 °C
Index of Refraction: 1.688
Molar Refractivity: 104.1±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.24
ACD/LogD (pH 5.5): 5.57
ACD/BCF (pH 5.5): 10073.00
ACD/KOC (pH 5.5): 25529.99
ACD/LogD (pH 7.4): 5.57
ACD/BCF (pH 7.4): 10073.00
ACD/KOC (pH 7.4): 25529.99
Polar Surface Area: 52 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 57.3±5.0 dyne/cm
Molar Volume: 273.1±5.0 cm3

Click to predict properties on the Chemicalize site


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