ChemSpider 2D Image | (6R)-6-{[(2R)-4-Oxo-6-(2-phenylethyl)-3,4-dihydro-2H-pyran-2-yl]methyl}-5,6-dihydro-2H-pyran-2-one | C19H20O4

(6R)-6-{[(2R)-4-Oxo-6-(2-phenylethyl)-3,4-dihydro-2H-pyran-2-yl]methyl}-5,6-dihydro-2H-pyran-2-one

  • Molecular FormulaC19H20O4
  • Average mass312.360 Da
  • Monoisotopic mass312.136169 Da
  • ChemSpider ID25060643

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(6R)-6-{[(2R)-4-Oxo-6-(2-phenylethyl)-3,4-dihydro-2H-pyran-2-yl]methyl}-5,6-dihydro-2H-pyran-2-on [German] [ACD/IUPAC Name]
(6R)-6-{[(2R)-4-Oxo-6-(2-phenylethyl)-3,4-dihydro-2H-pyran-2-yl]methyl}-5,6-dihydro-2H-pyran-2-one [ACD/IUPAC Name]
(6R)-6-{[(2R)-4-Oxo-6-(2-phényléthyl)-3,4-dihydro-2H-pyran-2-yl]méthyl}-5,6-dihydro-2H-pyran-2-one [French] [ACD/IUPAC Name]
2H-Pyran-2-one, 6-[[(2R)-3,4-dihydro-4-oxo-6-(2-phenylethyl)-2H-pyran-2-yl]methyl]-5,6-dihydro-, (6R)- [ACD/Index Name]
(2R)-2-[[(2R)-6-oxo-2,3-dihydropyran-2-yl]methyl]-6-(2-phenylethyl)-2,3-dihydropyran-4-one
(2R)-2α-[[(R)-6-Oxo-3,6-dihydro-2H-pyran-2β-yl]methyl]-6-phenethyl-3,4-dihydro-2H-pyran-4-one
1240403-82-0 [RN]
7',8'-Dihydroobolactone

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

Density: 1.2±0.1 g/cm3
Boiling Point: 514.3±39.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.6±3.0 kJ/mol
Flash Point: 227.9±27.1 °C
Index of Refraction: 1.558
Molar Refractivity: 85.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.42
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 93.98
ACD/KOC (pH 5.5): 899.32
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 93.98
ACD/KOC (pH 7.4): 899.32
Polar Surface Area: 53 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 264.5±3.0 cm3

Click to predict properties on the Chemicalize site


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