ChemSpider 2D Image | [(2S,4R)-4-Hydroxy-2-pyrrolidinyl]carbonyl dihydrogen phosphate | C5H10NO6P

[(2S,4R)-4-Hydroxy-2-pyrrolidinyl]carbonyl dihydrogen phosphate

  • Molecular FormulaC5H10NO6P
  • Average mass211.110 Da
  • Monoisotopic mass211.024567 Da
  • ChemSpider ID67162322

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[(2S,4R)-4-Hydroxy-2-pyrrolidinyl]carbonyl dihydrogen phosphate [ACD/IUPAC Name]
[(2S,4R)-4-Hydroxy-2-pyrrolidinyl]carbonyldihydrogenphosphat [German] [ACD/IUPAC Name]
Dihydrogénophosphate de [(2S,4R)-4-hydroxy-2-pyrrolidinyl]carbonyle [French] [ACD/IUPAC Name]
Methanone, [(2S,4R)-4-hydroxy-2-pyrrolidinyl](phosphonooxy)- [ACD/Index Name]
O-phosphohydroxyproline

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

Density: 1.7±0.1 g/cm3
Boiling Point: 490.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.2±6.0 kJ/mol
Flash Point: 250.2±31.5 °C
Index of Refraction: 1.563
Molar Refractivity: 39.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -3.51
ACD/LogD (pH 5.5): -5.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 126 Å2
Polarizability: 15.7±0.5 10-24cm3
Surface Tension: 87.1±3.0 dyne/cm
Molar Volume: 122.0±3.0 cm3

Click to predict properties on the Chemicalize site


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