ChemSpider 2D Image | Diphosphoric acid, mono[(2Z)-3,7-dimethyl-2,6-octadien-1-yl] ester, ion(3-) | C10H17O7P2

Diphosphoric acid, mono[(2Z)-3,7-dimethyl-2,6-octadien-1-yl] ester, ion(3-)

  • Molecular FormulaC10H17O7P2
  • Average mass311.187 Da
  • Monoisotopic mass311.046600 Da
  • ChemSpider ID24785181

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

Diphosphoric acid, mono[(2Z)-3,7-dimethyl-2,6-octadien-1-yl] ester, ion(3-) [ACD/Index Name]
&ω;,<i>Z&lt;/i>-neryl diphosphate
(2Z)-neryl diphosphate
(2Z)-3,7-dimethylocta-2,6-dien-1-yl diphosphate
Neryl diphosphate
neryl diphosphate trianion
neryl diphosphate(3-)
neryl pyrophosphate

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

NPP [DBID]
  • Miscellaneous

    • Chemical Class:

      An organophosphate oxoanion that is the trianion of neryl diphosphate, arising from deprotonation of the diphosphate OH groups; major species at pH 7.3. ChEBI CHEBI:57665

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

Density:
Boiling Point: 484.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 82.1±6.0 kJ/mol
Flash Point: 246.7±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.10
ACD/LogD (pH 5.5): -4.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.34
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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