Found 4 results

Search term: MF = 'C_{21}H_{14}F_{2}OS'
ChemSpider 2D Image | 1,1-Bis(4-fluorophenyl)-3-(phenylsulfanyl)-2-propyn-1-ol | C21H14F2OS

1,1-Bis(4-fluorophenyl)-3-(phenylsulfanyl)-2-propyn-1-ol

  • Molecular FormulaC21H14F2OS
  • Average mass352.397 Da
  • Monoisotopic mass352.073334 Da
  • ChemSpider ID74830454

More details:

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

1,1-Bis(4-fluorophenyl)-3-(phenylsulfanyl)-2-propyn-1-ol [ACD/IUPAC Name]
1,1-Bis(4-fluorophényl)-3-(phénylsulfanyl)-2-propyn-1-ol [French] [ACD/IUPAC Name]
1,1-Bis(4-fluorphenyl)-3-(phenylsulfanyl)-2-propin-1-ol [German] [ACD/IUPAC Name]
Benzenemethanol, 4-fluoro-α-(4-fluorophenyl)-α-[2-(phenylthio)ethynyl]- [ACD/Index 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: 503.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.4±3.0 kJ/mol
Flash Point: 258.4±32.9 °C
Index of Refraction: 1.666
Molar Refractivity: 97.9±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.51
ACD/LogD (pH 5.5): 6.16
ACD/BCF (pH 5.5): 28176.24
ACD/KOC (pH 5.5): 53310.16
ACD/LogD (pH 7.4): 6.16
ACD/BCF (pH 7.4): 28160.49
ACD/KOC (pH 7.4): 53280.38
Polar Surface Area: 46 Å2
Polarizability: 38.8±0.5 10-24cm3
Surface Tension: 58.8±5.0 dyne/cm
Molar Volume: 263.3±5.0 cm3

Click to predict properties on the Chemicalize site


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