ChemSpider 2D Image | (3S)-3-Phenyldihydro-2H-pyran-2,6(3H)-dione | C11H10O3

(3S)-3-Phenyldihydro-2H-pyran-2,6(3H)-dione

  • Molecular FormulaC11H10O3
  • Average mass190.195 Da
  • Monoisotopic mass190.062988 Da
  • ChemSpider ID113057867

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Phenyldihydro-2H-pyran-2,6(3H)-dion [German] [ACD/IUPAC Name]
(3S)-3-Phenyldihydro-2H-pyran-2,6(3H)-dione [ACD/IUPAC Name]
(3S)-3-Phényldihydro-2H-pyrane-2,6(3H)-dione [French] [ACD/IUPAC Name]
2H-Pyran-2,6(3H)-dione, dihydro-3-phenyl-, (3S)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 365.7±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.2±3.0 kJ/mol
Flash Point: 178.6±22.0 °C
Index of Refraction: 1.551
Molar Refractivity: 49.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.75
ACD/LogD (pH 5.5): 0.86
ACD/BCF (pH 5.5): 2.64
ACD/KOC (pH 5.5): 69.73
ACD/LogD (pH 7.4): 0.86
ACD/BCF (pH 7.4): 2.64
ACD/KOC (pH 7.4): 69.73
Polar Surface Area: 43 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 154.7±3.0 cm3

Click to predict properties on the Chemicalize site


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