ChemSpider 2D Image | 2-[(2R)-2-Methyl-2-oxiranyl]ethyl trihydrogen diphosphate | C5H12O8P2

2-[(2R)-2-Methyl-2-oxiranyl]ethyl trihydrogen diphosphate

  • Molecular FormulaC5H12O8P2
  • Average mass262.091 Da
  • Monoisotopic mass262.000732 Da
  • ChemSpider ID28503956

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-[(2R)-2-Methyl-2-oxiranyl]ethyl trihydrogen diphosphate [ACD/IUPAC Name]
2-[(2R)-2-Methyl-2-oxiranyl]ethyltrihydrogendiphosphat [German] [ACD/IUPAC Name]
Diphosphoric acid, mono[2-[(2R)-2-methyloxiranyl]ethyl] ester [ACD/Index Name]
Trihydrogénodiphosphate de 2-[(2R)-2-méthyl-2-oxiranyl]éthyle [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 456.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 78.6±6.0 kJ/mol
Flash Point: 230.0±26.5 °C
Index of Refraction: 1.518
Molar Refractivity: 46.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -3.07
ACD/LogD (pH 5.5): -7.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 145 Å2
Polarizability: 18.5±0.5 10-24cm3
Surface Tension: 84.5±3.0 dyne/cm
Molar Volume: 153.8±3.0 cm3

Click to predict properties on the Chemicalize site


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