ChemSpider 2D Image | 1-({[Hydroxy(phosphonooxy)phosphoryl]oxy}acetyl)-D-proline | C7H13NO10P2

1-({[Hydroxy(phosphonooxy)phosphoryl]oxy}acetyl)-D-proline

  • Molecular FormulaC7H13NO10P2
  • Average mass333.126 Da
  • Monoisotopic mass333.001465 Da
  • ChemSpider ID25031206

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-({[Hydroxy(phosphonooxy)phosphoryl]oxy}acetyl)-D-prolin [German] [ACD/IUPAC Name]
1-({[Hydroxy(phosphonooxy)phosphoryl]oxy}acetyl)-D-proline [ACD/IUPAC Name]
1-(2-{[Hydroxy(phosphonooxy)phosphoryl]oxy}acétyl)-D-proline [French] [ACD/IUPAC Name]
D-Proline, 1-[2-[[hydroxy(phosphonooxy)phosphinyl]oxy]acetyl]- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 687.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.6 mmHg at 25°C
Enthalpy of Vaporization: 109.9±6.0 kJ/mol
Flash Point: 369.7±34.3 °C
Index of Refraction: 1.584
Molar Refractivity: 59.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -3.51
ACD/LogD (pH 5.5): -9.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 191 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 105.6±3.0 dyne/cm
Molar Volume: 176.8±3.0 cm3

Click to predict properties on the Chemicalize site


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