ChemSpider 2D Image | (2R,3S,4R,5S)-2,3,4,5,7-Pentahydroxy-6-oxoheptyl dihydrogen phosphate | C7H15O10P

(2R,3S,4R,5S)-2,3,4,5,7-Pentahydroxy-6-oxoheptyl dihydrogen phosphate

  • Molecular FormulaC7H15O10P
  • Average mass290.162 Da
  • Monoisotopic mass290.040283 Da
  • ChemSpider ID29334487

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R,3S,4R,5S)-2,3,4,5,7-Pentahydroxy-6-oxoheptyl dihydrogen phosphate [ACD/IUPAC Name]
(2R,3S,4R,5S)-2,3,4,5,7-Pentahydroxy-6-oxoheptyldihydrogenphosphat [German] [ACD/IUPAC Name]
D-ido-2-Heptulose, 7-(dihydrogen phosphate) [ACD/Index Name]
Dihydrogénophosphate de (2R,3S,4R,5S)-2,3,4,5,7-pentahydroxy-6-oxoheptyle [French] [ACD/IUPAC Name]
D-ido-heptulose 7-phosphate

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

Density: 1.9±0.1 g/cm3
Boiling Point: 751.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 125.0±6.0 kJ/mol
Flash Point: 408.3±35.7 °C
Index of Refraction: 1.606
Molar Refractivity: 53.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -2.48
ACD/LogD (pH 5.5): -7.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 195 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 118.7±3.0 dyne/cm
Molar Volume: 155.8±3.0 cm3

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