ChemSpider 2D Image | 2,3-Dihydroxypropyl 3-oxodecanoate | C13H24O5

2,3-Dihydroxypropyl 3-oxodecanoate

  • Molecular FormulaC13H24O5
  • Average mass260.327 Da
  • Monoisotopic mass260.162384 Da
  • ChemSpider ID21105981

More details:

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

2,3-Dihydroxypropyl 3-oxodecanoate [ACD/IUPAC Name]
2,3-Dihydroxypropyl-3-oxodecanoat [German] [ACD/IUPAC Name]
3-Oxodécanoate de 2,3-dihydroxypropyle [French] [ACD/IUPAC Name]
91052-69-6 [RN]
Decanoic acid, 3-oxo-, 2,3-dihydroxypropyl ester [ACD/Index Name]
Q1YQ1OV1V7 [WLN]

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

8R74536WM6 [DBID]
UNII:8R74536WM6 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 404.7±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 75.8±6.0 kJ/mol
Flash Point: 145.3±18.1 °C
Index of Refraction: 1.473
Molar Refractivity: 67.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 1.92
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 20.19
ACD/KOC (pH 5.5): 299.16
ACD/LogD (pH 7.4): 2.02
ACD/BCF (pH 7.4): 20.17
ACD/KOC (pH 7.4): 298.79
Polar Surface Area: 84 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 239.1±3.0 cm3

Click to predict properties on the Chemicalize site


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