ChemSpider 2D Image | (2R,3S,6R)-6-Ethyl-3-hydroxy-2-(2-hydroxy-2-propanyl)-3,6-dihydrofuro[2,3-e][2]benzofuran-8(2H)-one | C15H18O5

(2R,3S,6R)-6-Ethyl-3-hydroxy-2-(2-hydroxy-2-propanyl)-3,6-dihydrofuro[2,3-e][2]benzofuran-8(2H)-one

  • Molecular FormulaC15H18O5
  • Average mass278.300 Da
  • Monoisotopic mass278.115417 Da
  • ChemSpider ID78440945

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2R,3S,6R)-6-Ethyl-3-hydroxy-2-(2-hydroxy-2-propanyl)-3,6-dihydrofuro[2,3-e][2]benzofuran-8(2H)-on [German] [ACD/IUPAC Name]
(2R,3S,6R)-6-Ethyl-3-hydroxy-2-(2-hydroxy-2-propanyl)-3,6-dihydrofuro[2,3-e][2]benzofuran-8(2H)-one [ACD/IUPAC Name]
(2R,3S,6R)-6-Éthyl-3-hydroxy-2-(2-hydroxy-2-propanyl)-3,6-dihydrofuro[2,3-e][2]benzofuran-8(2H)-one [French] [ACD/IUPAC Name]
Benzo[1,2-b:5,6-c']difuran-8(2H)-one, 6-ethyl-3,6-dihydro-3-hydroxy-2-(1-hydroxy-1-methylethyl)-, (2R,3S,6R)- [ACD/Index Name]
Daldinin A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 485.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.1±3.0 kJ/mol
Flash Point: 183.5±22.2 °C
Index of Refraction: 1.596
Molar Refractivity: 70.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.58
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 4.06
ACD/KOC (pH 5.5): 94.82
ACD/LogD (pH 7.4): 1.10
ACD/BCF (pH 7.4): 4.06
ACD/KOC (pH 7.4): 94.82
Polar Surface Area: 76 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 208.0±3.0 cm3

Click to predict properties on the Chemicalize site


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