ChemSpider 2D Image | 3-Phenyl[1,2]thiazolo[4,5-d]pyrimidin-7(4H)-one | C11H7N3OS

3-Phenyl[1,2]thiazolo[4,5-d]pyrimidin-7(4H)-one

  • Molecular FormulaC11H7N3OS
  • Average mass229.258 Da
  • Monoisotopic mass229.030975 Da
  • ChemSpider ID27443427

More details:

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

3-Phenyl[1,2]thiazolo[4,5-d]pyrimidin-7(4H)-on [German] [ACD/IUPAC Name]
3-Phenyl[1,2]thiazolo[4,5-d]pyrimidin-7(4H)-one [ACD/IUPAC Name]
3-Phényl[1,2]thiazolo[4,5-d]pyrimidin-7(4H)-one [French] [ACD/IUPAC Name]
3-phenyl-6H,7H-[1,2]thiazolo[4,5-d]pyrimidin-7-one
72632-99-6 [RN]
Isothiazolo[4,5-d]pyrimidin-7(6H)-one, 3-phenyl- [ACD/Index Name]
3-phenyl-6H,7H-pyrimido[4,5-d][1,2]thiazol-7-one
3-phenylisothiazolo[4,5-d]pyrimidin-7(6H)-one
MFCD14729164

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

Density: 1.5±0.1 g/cm3
Boiling Point: 420.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.5±3.0 kJ/mol
Flash Point: 208.3±26.5 °C
Index of Refraction: 1.787
Molar Refractivity: 63.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.12
ACD/LogD (pH 5.5): 1.46
ACD/BCF (pH 5.5): 7.54
ACD/KOC (pH 5.5): 147.76
ACD/LogD (pH 7.4): 1.45
ACD/BCF (pH 7.4): 7.36
ACD/KOC (pH 7.4): 144.26
Polar Surface Area: 83 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 66.8±7.0 dyne/cm
Molar Volume: 150.1±7.0 cm3

Click to predict properties on the Chemicalize site


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