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ChemSpider 2D Image | 2,2-Bis(hydroxymethyl)-1,3-propanediyl bis[dihydrogen (phosphate)] | C5H14O10P2

2,2-Bis(hydroxymethyl)-1,3-propanediyl bis[dihydrogen (phosphate)]

  • Molecular FormulaC5H14O10P2
  • Average mass296.106 Da
  • Monoisotopic mass296.006226 Da
  • ChemSpider ID67165172

More details:

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

1,3-Propanediol, 2,2-bis(hydroxymethyl)-, 1,3-bis(dihydrogen phosphate) [ACD/Index Name]
2,2-Bis(hydroxymethyl)-1,3-propandiylbis[dihydrogen(phosphat)] [German] [ACD/IUPAC Name]
2,2-Bis(hydroxymethyl)-1,3-propanediyl bis[dihydrogen (phosphate)] [ACD/IUPAC Name]
Bis[dihydrogéno(phosphate)] de 2,2-bis(hydroxyméthyl)-1,3-propanediyle [French] [ACD/IUPAC Name]
pentaerythritol bisphosphorate

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

Density: 1.9±0.1 g/cm3
Boiling Point: 679.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.1±6.0 kJ/mol
Flash Point: 365.0±34.3 °C
Index of Refraction: 1.571
Molar Refractivity: 51.6±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -3.44
ACD/LogD (pH 5.5): -8.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 194 Å2
Polarizability: 20.5±0.5 10-24cm3
Surface Tension: 111.0±3.0 dyne/cm
Molar Volume: 157.2±3.0 cm3

Click to predict properties on the Chemicalize site


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