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Search term: NGFSMHKFTZROKJ-MMSZMYIBSA-K (Found by InChIKey (full match))
ChemSpider 2D Image | Diphosphoric acid, mono[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyl-2,6,10,14,18,22-tetracosahexaen-1-yl] ester, ion(3-) | C30H49O7P2

Diphosphoric acid, mono[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyl-2,6,10,14,18,22-tetracosahexaen-1-yl] ester, ion(3-)

  • Molecular FormulaC30H49O7P2
  • Average mass583.655 Da
  • Monoisotopic mass583.296997 Da
  • ChemSpider ID26331063

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

Diphosphoric acid, mono[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyl-2,6,10,14,18,22-tetracosahexaen-1-yl] ester, ion(3-) [ACD/Index Name]
(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl diphosphate
(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl diphosphate trianion
all-trans-hexaprenyl diphosphate
all-trans-hexaprenyl diphosphate
all-trans-hexaprenyl diphosphate trianion
all-trans-hexaprenyl diphosphate(3-)
hexaprenyl-diphosphate
  • Miscellaneous

    • Chemical Class:

      The trianion resulting from the removal of the three protons from the diphosphate group of all-trans-hexaprenyl diphosphate; major species at pH 7.3. ChEBI CHEBI:58179

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

Density:
Boiling Point: 680.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 108.8±6.0 kJ/mol
Flash Point: 365.4±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 2
ACD/LogP: 9.24
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 3.76
ACD/KOC (pH 5.5): 4.61
ACD/LogD (pH 7.4): 1.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 141 Å2
Polarizability:
Surface Tension:
Molar Volume:

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