ChemSpider 2D Image | 2-Hydroxy-3-(octanoyloxy)propyl decanoate | C21H40O5

2-Hydroxy-3-(octanoyloxy)propyl decanoate

  • Molecular FormulaC21H40O5
  • Average mass372.539 Da
  • Monoisotopic mass372.287567 Da
  • ChemSpider ID34990997

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-Hydroxy-3-(octanoyloxy)propyl decanoate [ACD/IUPAC Name]
2-Hydroxy-3-(octanoyloxy)propyl-decanoat [German] [ACD/IUPAC Name]
Décanoate de 2-hydroxy-3-(octanoyloxy)propyle [French] [ACD/IUPAC Name]
Decanoic acid, 2-hydroxy-3-[(1-oxooctyl)oxy]propyl ester [ACD/Index Name]
(2S)-2-hydroxy-3-(octanoyloxy)propyl decanoate
[2-hydroxy-1-(hydroxymethyl)ethyl] decanoate
1,3-Dihydroxypropan-2-yl decanoate
287-075-5 [EINECS]
301-065-0 [EINECS]
3376-48-5 [RN]
More...

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

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

Density: 1.0±0.1 g/cm3
Boiling Point: 466.2±12.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.9±6.0 kJ/mol
Flash Point: 147.0±13.1 °C
Index of Refraction: 1.462
Molar Refractivity: 104.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 1
ACD/LogP: 6.90
ACD/LogD (pH 5.5): 7.17
ACD/BCF (pH 5.5): 164564.36
ACD/KOC (pH 5.5): 188551.39
ACD/LogD (pH 7.4): 7.17
ACD/BCF (pH 7.4): 164563.45
ACD/KOC (pH 7.4): 188550.34
Polar Surface Area: 73 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 36.1±3.0 dyne/cm
Molar Volume: 380.0±3.0 cm3

Click to predict properties on the Chemicalize site


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