ChemSpider 2D Image | 3,7-Diphenylthieno[3,2-d]pyrimidin-4(3H)-one | C18H12N2OS

3,7-Diphenylthieno[3,2-d]pyrimidin-4(3H)-one

  • Molecular FormulaC18H12N2OS
  • Average mass304.366 Da
  • Monoisotopic mass304.067047 Da
  • ChemSpider ID58116010

More details:

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

3,7-Diphenylthieno[3,2-d]pyrimidin-4(3H)-on [German] [ACD/IUPAC Name]
3,7-Diphenylthieno[3,2-d]pyrimidin-4(3H)-one [ACD/IUPAC Name]
3,7-Diphénylthiéno[3,2-d]pyrimidin-4(3H)-one [French] [ACD/IUPAC Name]
Thieno[3,2-d]pyrimidin-4(3H)-one, 3,7-diphenyl- [ACD/Index Name]
1621966-56-0 [RN]
MFCD31555915

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

Density: 1.3±0.1 g/cm3
Boiling Point: 490.5±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.7±3.0 kJ/mol
Flash Point: 250.5±29.3 °C
Index of Refraction: 1.699
Molar Refractivity: 91.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.77
ACD/LogD (pH 5.5): 3.73
ACD/BCF (pH 5.5): 406.04
ACD/KOC (pH 5.5): 2563.39
ACD/LogD (pH 7.4): 3.73
ACD/BCF (pH 7.4): 406.04
ACD/KOC (pH 7.4): 2563.39
Polar Surface Area: 61 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 54.2±7.0 dyne/cm
Molar Volume: 235.6±7.0 cm3

Click to predict properties on the Chemicalize site


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