ChemSpider 2D Image | 1-(3,4-Dimethoxyphenyl)-3H-[1]benzothieno[2,3-c]pyran-3-one | C19H14O4S

1-(3,4-Dimethoxyphenyl)-3H-[1]benzothieno[2,3-c]pyran-3-one

  • Molecular FormulaC19H14O4S
  • Average mass338.377 Da
  • Monoisotopic mass338.061279 Da
  • ChemSpider ID29844564

More details:

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

1-(3,4-Dimethoxyphenyl)-3H-[1]benzothieno[2,3-c]pyran-3-on [German] [ACD/IUPAC Name]
1-(3,4-Dimethoxyphenyl)-3H-[1]benzothieno[2,3-c]pyran-3-one [ACD/IUPAC Name]
1-(3,4-Diméthoxyphényl)-3H-[1]benzothiéno[2,3-c]pyran-3-one [French] [ACD/IUPAC Name]
3H-[1]Benzothieno[2,3-c]pyran-3-one, 1-(3,4-dimethoxyphenyl)- [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: 542.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.1±3.0 kJ/mol
Flash Point: 282.4±18.1 °C
Index of Refraction: 1.690
Molar Refractivity: 92.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 3.98
ACD/BCF (pH 5.5): 626.54
ACD/KOC (pH 5.5): 3496.71
ACD/LogD (pH 7.4): 3.98
ACD/BCF (pH 7.4): 626.54
ACD/KOC (pH 7.4): 3496.71
Polar Surface Area: 70 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 61.6±5.0 dyne/cm
Molar Volume: 241.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement