ChemSpider 2D Image | 4-(6-Amino-9H-purin-9-yl)butyl dihydrogen phosphate | C9H14N5O4P

4-(6-Amino-9H-purin-9-yl)butyl dihydrogen phosphate

  • Molecular FormulaC9H14N5O4P
  • Average mass287.212 Da
  • Monoisotopic mass287.078339 Da
  • ChemSpider ID24627441

More details:

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

4-(6-Amino-9H-purin-9-yl)butyl dihydrogen phosphate [ACD/IUPAC Name]
4-(6-Amino-9H-purin-9-yl)butyldihydrogenphosphat [German] [ACD/IUPAC Name]
9H-Purine-9-butanol, 6-amino-, dihydrogen phosphate (ester) [ACD/Index Name]
Dihydrogénophosphate de 4-(6-amino-9H-purin-9-yl)butyle [French] [ACD/IUPAC 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: 617.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.3±3.0 kJ/mol
Flash Point: 327.5±34.3 °C
Index of Refraction: 1.737
Molar Refractivity: 64.8±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -1.25
ACD/LogD (pH 5.5): -4.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 93.9±7.0 dyne/cm
Molar Volume: 161.0±7.0 cm3

Click to predict properties on the Chemicalize site


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