ChemSpider 2D Image | Diphosphoric acid, mono(3-methyl-4-oxobutyl) ester, ion(3-) | C5H9O8P2

Diphosphoric acid, mono(3-methyl-4-oxobutyl) ester, ion(3-)

  • Molecular FormulaC5H9O8P2
  • Average mass259.069 Da
  • Monoisotopic mass258.978912 Da
  • ChemSpider ID57535354

  • Charge - Charge

More details:

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

Diphosphoric acid, mono(3-methyl-4-oxobutyl) ester, ion(3-) [ACD/Index Name]
252663-87-9 [RN]
PUBCHEM_71356553

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

Density:
Boiling Point: 484.7±47.0 °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: 246.9±29.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -2.34
ACD/LogD (pH 5.5): -7.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 158 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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