ChemSpider 2D Image | 11-octacosanone, 27-amino-2-[[(1E)-ethoxyhydroxymethylene]amino]-26-[(5xi)-L-ribo-hexopyranosyloxy]-3-hydroxy-, (2R,3R,26R,27R)- | C37H72N2O10

11-octacosanone, 27-amino-2-[[(1E)-ethoxyhydroxymethylene]amino]-26-[(5ξ)-L-ribo-hexopyranosyloxy]-3-hydroxy-, (2R,3R,26R,27R)-

  • Molecular FormulaC37H72N2O10
  • Average mass704.975 Da
  • Monoisotopic mass704.518677 Da
  • ChemSpider ID21431283

  • defined stereocentres - 7 of 9 defined stereocentres

More details:

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

11-octacosanone, 27-amino-2-[[(1E)-ethoxyhydroxymethylene]amino]-26-[(5ξ)-L-ribo-hexopyranosyloxy]-3-hydroxy-, (2R,3R,26R,27R)-

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

Density: 1.2±0.1 g/cm3
Boiling Point: 830.3±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 137.3±6.0 kJ/mol
Flash Point: 456.0±37.1 °C
Index of Refraction: 1.532
Molar Refractivity: 185.1±0.5 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 31
#Rule of 5 Violations: 4
ACD/LogP: 5.76
ACD/LogD (pH 5.5): 0.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.21
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 7.52
ACD/KOC (pH 7.4): 44.36
Polar Surface Area: 205 Å2
Polarizability: 73.4±0.5 10-24cm3
Surface Tension: 42.9±7.0 dyne/cm
Molar Volume: 597.6±7.0 cm3

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