ChemSpider 2D Image | 6-[(Hydroxyphosphinato)oxy]-1,2,3,4,5-cyclohexanepentayl pentakis(phosphate) | C6H7O24P6

6-[(Hydroxyphosphinato)oxy]-1,2,3,4,5-cyclohexanepentayl pentakis(phosphate)

  • Molecular FormulaC6H7O24P6
  • Average mass648.954 Da
  • Monoisotopic mass648.781311 Da
  • ChemSpider ID24785082
  • Charge - Charge

More details:

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

1,2,3,4,5,6-Cyclohexanehexol, hexakis(dihydrogen phosphate), ion(11-) [ACD/Index Name]
6-[(Hydroxyphosphinato)oxy]-1,2,3,4,5-cyclohexanepentayl pentakis(phosphate) [ACD/IUPAC Name]
6-[(Hydroxyphosphinato)oxy]-1,2,3,4,5-cyclohexanpentaylpentakis(phosphat) [German] [ACD/IUPAC Name]
Pentakis(phosphate) de 6-[(hydroxyphosphinato)oxy]-1,2,3,4,5-cyclohexanepentayle [French] [ACD/IUPAC Name]
phytate [Wiki]
phytic acid*myo-inositol hexakisphosphate*1D-myo-Inositol 1,2,3,4,5,6-hexakisphosphate*D-myo-Inositol 1,2,3,4,5,6-hexakisphosphate*myo-Inositol 1,2,3,4,5,6-hexakisphosphate*Inositol 1,2,3,4,5,6-hexakisphosphate*InsP6

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

Boiling Point: 1190.7±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 190.9±6.0 kJ/mol
Flash Point: 673.9±37.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 24
#H bond donors: 12
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: -8.47
ACD/LogD (pH 5.5): -18.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -23.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 491 Å2
Surface Tension:
Molar Volume:

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