ChemSpider 2D Image | 1-Hydroxy-3-(phosphonooxy)-2-propanyl alaninate | C6H14NO7P

1-Hydroxy-3-(phosphonooxy)-2-propanyl alaninate

  • Molecular FormulaC6H14NO7P
  • Average mass243.152 Da
  • Monoisotopic mass243.050781 Da
  • ChemSpider ID129307430

More details:

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

1-Hydroxy-3-(phosphonooxy)-2-propanyl alaninate [ACD/IUPAC Name]
1-Hydroxy-3-(phosphonooxy)-2-propanylalaninat [German] [ACD/IUPAC Name]
Alaninate de 1-hydroxy-3-(phosphonooxy)-2-propanyle [French] [ACD/IUPAC Name]
Alanine, 2-hydroxy-1-[(phosphonooxy)methyl]ethyl ester [ACD/Index Name]
(D-Ala1->2Gro-1-P)n
Alanyl-poly(glycerolphosphate)

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

C03999 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 489.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.1±6.0 kJ/mol
Flash Point: 249.8±31.5 °C
Index of Refraction: 1.521
Molar Refractivity: 48.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -2.46
ACD/LogD (pH 5.5): -5.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 149 Å2
Polarizability: 19.1±0.5 10-24cm3
Surface Tension: 71.8±3.0 dyne/cm
Molar Volume: 158.5±3.0 cm3

Click to predict properties on the Chemicalize site


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