ChemSpider 2D Image | [1-(6-Amino-2-hydroxy-9H-purin-8-yl)propyl]phosphonic acid | C8H12N5O4P

[1-(6-Amino-2-hydroxy-9H-purin-8-yl)propyl]phosphonic acid

  • Molecular FormulaC8H12N5O4P
  • Average mass273.186 Da
  • Monoisotopic mass273.062683 Da
  • ChemSpider ID84300281

More details:

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

[1-(6-Amino-2-hydroxy-9H-purin-8-yl)propyl]phosphonic acid [ACD/IUPAC Name]
[1-(6-Amino-2-hydroxy-9H-purin-8-yl)propyl]phosphonsäure [German] [ACD/IUPAC Name]
Acide [1-(6-amino-2-hydroxy-9H-purin-8-yl)propyl]phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [1-(6-amino-2-hydroxy-9H-purin-8-yl)propyl]- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 827.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 126.1±3.0 kJ/mol
Flash Point: 454.4±37.1 °C
Index of Refraction: 1.772
Molar Refractivity: 63.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -3.47
ACD/LogD (pH 5.5): -5.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 168 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 133.2±3.0 dyne/cm
Molar Volume: 151.5±3.0 cm3

Click to predict properties on the Chemicalize site


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