Found 1 result

Search term: MRFXFWDDKXBNOQ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (5R,7R,9R)-7,9-dihydroxy-5-decanolide | C10H18O4

(5R,7R,9R)-7,9-dihydroxy-5-decanolide

  • Molecular FormulaC10H18O4
  • Average mass202.247 Da
  • Monoisotopic mass202.120514 Da
  • ChemSpider ID62702367

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(5R,7R,9R)-7,9-dihydroxy-5-decanolide
(6R)-6-[(2R,4R)-2,4-Dihydroxypentyl]tetrahydro-2H-pyran-2-on [German] [ACD/IUPAC Name]
(6R)-6-[(2R,4R)-2,4-Dihydroxypentyl]tetrahydro-2H-pyran-2-one [ACD/IUPAC Name]
(6R)-6-[(2R,4R)-2,4-Dihydroxypentyl]tétrahydro-2H-pyran-2-one [French] [ACD/IUPAC Name]
2H-Pyran-2-one, 6-[(2R,4R)-2,4-dihydroxypentyl]tetrahydro-, (6R)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 423.9±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±6.0 kJ/mol
Flash Point: 168.5±13.9 °C
Index of Refraction: 1.489
Molar Refractivity: 51.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.04
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.18
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.18
Polar Surface Area: 67 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 43.6±3.0 dyne/cm
Molar Volume: 176.9±3.0 cm3

Click to predict properties on the Chemicalize site


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