Found 66 results

Search term: MF = 'C_{21}H_{20}OS'

ChemSpider 2D Image | 3-(2-Naphthylsulfanyl)-2-phenyltetrahydro-2H-pyran | C21H20OS

3-(2-Naphthylsulfanyl)-2-phenyltetrahydro-2H-pyran

  • Molecular FormulaC21H20OS
  • Average mass320.448 Da
  • Monoisotopic mass320.123474 Da
  • ChemSpider ID65326862

More details:






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

2H-Pyran, tetrahydro-3-(2-naphthalenylthio)-2-phenyl- [ACD/Index Name]
3-(2-Naphthylsulfanyl)-2-phenyltetrahydro-2H-pyran [German] [ACD/IUPAC Name]
3-(2-Naphthylsulfanyl)-2-phenyltetrahydro-2H-pyran [ACD/IUPAC Name]
3-(2-Naphtylsulfanyl)-2-phényltétrahydro-2H-pyrane [French] [ACD/IUPAC Name]
(2R,3S)-3-(Naphthalen-2-ylthio)-2-phenyltetrahydro-2H-pyran

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

Density: 1.2±0.1 g/cm3
Boiling Point: 502.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.2±3.0 kJ/mol
Flash Point: 257.7±30.1 °C
Index of Refraction: 1.667
Molar Refractivity: 99.8±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.75
ACD/LogD (pH 5.5): 5.86
ACD/BCF (pH 5.5): 16725.74
ACD/KOC (pH 5.5): 36701.71
ACD/LogD (pH 7.4): 5.86
ACD/BCF (pH 7.4): 16725.74
ACD/KOC (pH 7.4): 36701.71
Polar Surface Area: 35 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 52.5±5.0 dyne/cm
Molar Volume: 268.2±5.0 cm3

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