ChemSpider 2D Image | icos#18 | C26H37NO7

icos#18

  • Molecular FormulaC26H37NO7
  • Average mass475.574 Da
  • Monoisotopic mass475.256989 Da
  • ChemSpider ID31150695

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

11-{[3,6-Dideoxy-4-O-(1H-indol-3-ylcarbonyl)-α-L-arabino-hexopyranosyl]oxy}undecanoic acid [ACD/IUPAC Name]
11-{[3,6-Didesoxy-4-O-(1H-indol-3-ylcarbonyl)-α-L-arabino-hexopyranosyl]oxy}undecansäure [German] [ACD/IUPAC Name]
1355683-18-9 [RN]
Acide 11-{[3,6-didésoxy-4-O-(1H-indol-3-ylcarbonyl)-α-L-arabino-hexopyranosyl]oxy}undécanoïque [French] [ACD/IUPAC Name]
icos#18
Undecanoic acid, 11-[[3,6-dideoxy-4-O-(1H-indol-3-ylcarbonyl)-α-L-arabino-hexopyranosyl]oxy]- [ACD/Index Name]
11-((1H-indol-3-ylcarbonyl)3,6-dideoxy-α-L-arabino-hexopyranosyloxy)-undecanoic acid
11-(3'R-hydroxy-5'R-O-(1H-indol-3-ylcarbonyl)-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-undecanoic acid

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

Density: 1.2±0.1 g/cm3
Boiling Point: 677.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.4±3.0 kJ/mol
Flash Point: 363.4±31.5 °C
Index of Refraction: 1.576
Molar Refractivity: 128.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 5.61
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 680.99
ACD/KOC (pH 5.5): 2203.94
ACD/LogD (pH 7.4): 2.49
ACD/BCF (pH 7.4): 10.92
ACD/KOC (pH 7.4): 35.35
Polar Surface Area: 118 Å2
Polarizability: 50.7±0.5 10-24cm3
Surface Tension: 56.0±5.0 dyne/cm
Molar Volume: 387.0±5.0 cm3

Click to predict properties on the Chemicalize site


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