ChemSpider 2D Image | 7-Phenyl-6-(trifluoromethyl)thieno[3,2-d]pyrimidin-4(1H)-one | C13H7F3N2OS

7-Phenyl-6-(trifluoromethyl)thieno[3,2-d]pyrimidin-4(1H)-one

  • Molecular FormulaC13H7F3N2OS
  • Average mass296.268 Da
  • Monoisotopic mass296.023102 Da
  • ChemSpider ID24808444

More details:

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

7-Phenyl-6-(trifluormethyl)thieno[3,2-d]pyrimidin-4(1H)-on [German] [ACD/IUPAC Name]
7-Phenyl-6-(trifluoromethyl)thieno[3,2-d]pyrimidin-4(1H)-one [ACD/IUPAC Name]
7-Phényl-6-(trifluorométhyl)thiéno[3,2-d]pyrimidin-4(1H)-one [French] [ACD/IUPAC Name]
Thieno[3,2-d]pyrimidin-4(3H)-one, 7-phenyl-6-(trifluoromethyl)- [ACD/Index Name]
Kinome_3262

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

Density: 1.5±0.1 g/cm3
Boiling Point: 466.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.9±3.0 kJ/mol
Flash Point: 236.1±28.7 °C
Index of Refraction: 1.648
Molar Refractivity: 69.7±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.58
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 169.77
ACD/KOC (pH 5.5): 1373.21
ACD/LogD (pH 7.4): 3.23
ACD/BCF (pH 7.4): 168.85
ACD/KOC (pH 7.4): 1365.77
Polar Surface Area: 70 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 47.1±7.0 dyne/cm
Molar Volume: 191.7±7.0 cm3

Click to predict properties on the Chemicalize site


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