ChemSpider 2D Image | 2-O-(Isopropoxycarbonyl)-6-O-palmitoyl-L-threo-hex-1-enofuranos-3-ulose | C26H44O9

2-O-(Isopropoxycarbonyl)-6-O-palmitoyl-L-threo-hex-1-enofuranos-3-ulose

  • Molecular FormulaC26H44O9
  • Average mass500.622 Da
  • Monoisotopic mass500.298523 Da
  • ChemSpider ID9169903

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

2-O-(Isopropoxycarbonyl)-6-O-palmitoyl-L-threo-hex-1-enofuranos-3-ulose [ACD/IUPAC Name]
2-O-(Isopropoxycarbonyl)-6-O-palmitoyl-L-threo-hex-1-enofuranos-3-ulose [German] [ACD/IUPAC Name]
2-O-(Isopropoxycarbonyl)-6-O-palmitoyl-L-thréo-hex-1-énofuranos-3-ulose [French] [ACD/IUPAC Name]
L-threo-Hex-1-enofuranos-3-ulose, 2-O-[(1-methylethoxy)carbonyl]-6-O-(1-oxohexadecyl)- [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: 596.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 102.0±6.0 kJ/mol
Flash Point: 186.2±23.6 °C
Index of Refraction: 1.504
Molar Refractivity: 130.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 2
ACD/LogP: 7.39
ACD/LogD (pH 5.5): 5.33
ACD/BCF (pH 5.5): 3746.73
ACD/KOC (pH 5.5): 6368.38
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 64.63
ACD/KOC (pH 7.4): 109.86
Polar Surface Area: 129 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 46.2±5.0 dyne/cm
Molar Volume: 440.0±5.0 cm3

Click to predict properties on the Chemicalize site


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