ChemSpider 2D Image | 1-deoxy-D-threo-hexo-2,5-diulose 6-phosphate | C6H11O8P

1-deoxy-D-threo-hexo-2,5-diulose 6-phosphate

  • Molecular FormulaC6H11O8P
  • Average mass242.120 Da
  • Monoisotopic mass242.019150 Da
  • ChemSpider ID21865858

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-Deoxy-6-O-phosphono-D-threo-hexo-2,5-diulose [ACD/IUPAC Name]
1-deoxy-D-threo-hexo-2,5-diulose 6-phosphate
1-Desoxy-6-O-phosphono-D-threo-hexo-2,5-diulose [German] [ACD/IUPAC Name]
1-Désoxy-6-O-phosphono-D-thréo-hexo-2,5-diulose [French] [ACD/IUPAC Name]
D-threo-2,5-Hexodiulose, 1-deoxy-, 6-(dihydrogen phosphate) [ACD/Index Name]
1-deoxy-D-threo-hexo-2,5-diulose 6-(dihydrogen phosphate)
6-Deoxy-5-ketofructose 1-phosphate

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

Density: 1.7±0.1 g/cm3
Boiling Point: 582.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 100.0±6.0 kJ/mol
Flash Point: 306.2±32.9 °C
Index of Refraction: 1.535
Molar Refractivity: 44.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.22
ACD/LogD (pH 5.5): -5.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 151 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 85.0±3.0 dyne/cm
Molar Volume: 143.1±3.0 cm3

Click to predict properties on the Chemicalize site


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