ChemSpider 2D Image | (2R,3R,4R,5R)-6,6-Diethoxy-1,2,3,4,5-hexanepentayl pentaacetate (non-preferred name) | C20H32O12

(2R,3R,4R,5R)-6,6-Diethoxy-1,2,3,4,5-hexanepentayl pentaacetate (non-preferred name)

  • Molecular FormulaC20H32O12
  • Average mass464.461 Da
  • Monoisotopic mass464.189362 Da
  • ChemSpider ID62336462

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R,3R,4R,5R)-6,6-Diethoxy-1,2,3,4,5-hexanepentayl pentaacetate (non-preferred name) [ACD/IUPAC Name]
(2R,3R,4R,5R)-6,6-Diethoxy-1,2,3,4,5-hexanpentayl-pentaacetat (non-preferred name) [German] [ACD/IUPAC Name]
Pentaacétate de (2R,3R,4R,5R)-6,6-diéthoxy-1,2,3,4,5-hexanepentayle (non-preferred name) [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 487.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.3±3.0 kJ/mol
Flash Point: 206.3±28.8 °C
Index of Refraction: 1.459
Molar Refractivity: 106.9±0.3 cm3
#H bond acceptors: 12
#H bond donors: 0
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 1
ACD/LogP: 2.50
ACD/LogD (pH 5.5): 1.75
ACD/BCF (pH 5.5): 12.60
ACD/KOC (pH 5.5): 213.47
ACD/LogD (pH 7.4): 1.75
ACD/BCF (pH 7.4): 12.60
ACD/KOC (pH 7.4): 213.47
Polar Surface Area: 150 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 390.7±3.0 cm3

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