ChemSpider 2D Image | 3-(3-Chlorophenyl)-7-phenylthieno[3,2-d]pyrimidin-4(3H)-one | C18H11ClN2OS

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

  • Molecular FormulaC18H11ClN2OS
  • Average mass338.811 Da
  • Monoisotopic mass338.028076 Da
  • ChemSpider ID58116102

More details:

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

3-(3-Chlorophenyl)-7-phenylthieno[3,2-d]pyrimidin-4(3H)-one [ACD/IUPAC Name]
3-(3-Chlorophényl)-7-phénylthiéno[3,2-d]pyrimidin-4(3H)-one [French] [ACD/IUPAC Name]
3-(3-Chlorphenyl)-7-phenylthieno[3,2-d]pyrimidin-4(3H)-on [German] [ACD/IUPAC Name]
Thieno[3,2-d]pyrimidin-4(3H)-one, 3-(3-chlorophenyl)-7-phenyl- [ACD/Index Name]
1621966-63-9 [RN]
MFCD31555935

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

Density: 1.4±0.1 g/cm3
Boiling Point: 528.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.4±3.0 kJ/mol
Flash Point: 273.7±32.9 °C
Index of Refraction: 1.709
Molar Refractivity: 95.6±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.37
ACD/LogD (pH 5.5): 4.30
ACD/BCF (pH 5.5): 1097.10
ACD/KOC (pH 5.5): 5221.64
ACD/LogD (pH 7.4): 4.30
ACD/BCF (pH 7.4): 1097.10
ACD/KOC (pH 7.4): 5221.64
Polar Surface Area: 61 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 55.4±7.0 dyne/cm
Molar Volume: 244.9±7.0 cm3

Click to predict properties on the Chemicalize site


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