ChemSpider 2D Image | (2R)-2,3-Bis(formyloxy)propyl (2R,3R,5S,6R)-2,3,5,6-tetrahydroxy-4-(phosphonatooxy)cyclohexyl phosphate | C11H17O16P2

(2R)-2,3-Bis(formyloxy)propyl (2R,3R,5S,6R)-2,3,5,6-tetrahydroxy-4-(phosphonatooxy)cyclohexyl phosphate

  • Molecular FormulaC11H17O16P2
  • Average mass467.192 Da
  • Monoisotopic mass467.000824 Da
  • ChemSpider ID78315970

  • Charge - Charge

    defined stereocentres - 5 of 7 defined stereocentres

More details:

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

(2R)-2,3-Bis(formyloxy)propyl (2R,3R,5S,6R)-2,3,5,6-tetrahydroxy-4-(phosphonatooxy)cyclohexyl phosphate [ACD/IUPAC Name]
(2R)-2,3-Bis(formyloxy)propyl-(2R,3R,5S,6R)-2,3,5,6-tetrahydroxy-4-(phosphonatooxy)cyclohexylphosphat [German] [ACD/IUPAC Name]
Phosphate de (2R)-2,3-bis(formyloxy)propyle et de (2R,3R,5S,6R)-2,3,5,6-tétrahydroxy-4-(phosphonatooxy)cyclohexyle [French] [ACD/IUPAC Name]
Phosphoric acid, (2R)-2,3-bis(formyloxy)propyl (2R,3R,5S,6R)-2,3,5,6-tetrahydroxy-4-(phosphonooxy)cyclohexyl ester, ion(3-) [ACD/Index Name]

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

Density:
Boiling Point: 769.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.9 mmHg at 25°C
Enthalpy of Vaporization: 127.7±6.0 kJ/mol
Flash Point: 419.2±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 16
#H bond donors: 7
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: -2.07
ACD/LogD (pH 5.5): -8.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 284 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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