ChemSpider 2D Image | 6-O-Phosphonato-D-ribo-hexopyranos-3-ulose | C6H9O9P

6-O-Phosphonato-D-ribo-hexopyranos-3-ulose

  • Molecular FormulaC6H9O9P
  • Average mass256.105 Da
  • Monoisotopic mass255.999512 Da
  • ChemSpider ID29368475

  • Charge - Charge

    defined stereocentres - 3 of 4 defined stereocentres

More details:

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

6-O-Phosphonato-D-ribo-hexopyranos-3-ulose [ACD/IUPAC Name]
6-O-Phosphonato-D-ribo-hexopyranos-3-ulose [German] [ACD/IUPAC Name]
6-O-Phosphonato-D-ribo-hexopyranos-3-ulose [French] [ACD/IUPAC Name]
D-ribo-Hexopyranos-3-ulose, 6-(dihydrogen phosphate), ion(2-) [ACD/Index Name]
3-dehydro-D-glucose 6-phosphate
3-dehydro-D-glucose-6-phosphate(2-)
3-keto-D-glucose-6-phosphate(2-)
  • Miscellaneous

    • Chemical Class:

      An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of 3-dehydro-D-glucose-6-phosphate. ChEBI CHEBI:75052

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

Density:
Boiling Point: 627.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.2 mmHg at 25°C
Enthalpy of Vaporization: 106.4±6.0 kJ/mol
Flash Point: 333.1±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.71
ACD/LogD (pH 5.5): -5.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 169 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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