ChemSpider 2D Image | (1R,2S,3R,4S,5S,6R)-3,4,5,6-Tetrahydroxy-1,2-cyclohexanediyl bis[hydrogen (phosphate)] | C6H12O12P2

(1R,2S,3R,4S,5S,6R)-3,4,5,6-Tetrahydroxy-1,2-cyclohexanediyl bis[hydrogen (phosphate)]

  • Molecular FormulaC6H12O12P2
  • Average mass338.101 Da
  • Monoisotopic mass337.981506 Da
  • ChemSpider ID21467669

  • Charge - Charge

    defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(1R,2S,3R,4S,5S,6R)-3,4,5,6-Tetrahydroxy-1,2-cyclohexandiylbis[hydrogen(phosphat)] [German] [ACD/IUPAC Name]
(1R,2S,3R,4S,5S,6R)-3,4,5,6-Tetrahydroxy-1,2-cyclohexanediyl bis[hydrogen (phosphate)] [ACD/IUPAC Name]
1,2,3,4,5,6-Cyclohexanehexol, 1,2-bis(dihydrogen phosphate), ion(2-), (1R,2S,3R,4S,5S,6R)- [ACD/Index Name]
Bis[hydrogéno(phosphate)] de (1R,2S,3R,4S,5S,6R)-3,4,5,6-tétrahydroxy-1,2-cyclohexanediyle [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point: 686.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 115.2±6.0 kJ/mol
Flash Point: 369.1±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -1.83
ACD/LogD (pH 5.5): -8.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 240 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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