ChemSpider 2D Image | 2-(4-Fluorophenyl)-7-methoxy-4H-chromene-4-thione | C16H11FO2S

2-(4-Fluorophenyl)-7-methoxy-4H-chromene-4-thione

  • Molecular FormulaC16H11FO2S
  • Average mass286.321 Da
  • Monoisotopic mass286.046387 Da
  • ChemSpider ID24659134

More details:

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

2-(4-Fluorophenyl)-7-methoxy-4H-chromene-4-thione [ACD/IUPAC Name]
2-(4-Fluorophényl)-7-méthoxy-4H-chromène-4-thione [French] [ACD/IUPAC Name]
2-(4-Fluorphenyl)-7-methoxy-4H-chromen-4-thion [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-thione, 2-(4-fluorophenyl)-7-methoxy- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 402.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.8±3.0 kJ/mol
Flash Point: 197.3±31.5 °C
Index of Refraction: 1.662
Molar Refractivity: 78.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.89
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 908.09
ACD/KOC (pH 5.5): 4560.68
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 908.09
ACD/KOC (pH 7.4): 4560.68
Polar Surface Area: 51 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 57.7±5.0 dyne/cm
Molar Volume: 211.6±5.0 cm3

Click to predict properties on the Chemicalize site


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