ChemSpider 2D Image | 9-(5-O-{[(5-Amino-6-oxohexyl)amino](hydroxy)phosphoryl}pentofuranosyl)-9H-purin-6-amine | C16H26N7O7P

9-(5-O-{[(5-Amino-6-oxohexyl)amino](hydroxy)phosphoryl}pentofuranosyl)-9H-purin-6-amine

  • Molecular FormulaC16H26N7O7P
  • Average mass459.394 Da
  • Monoisotopic mass459.163147 Da
  • ChemSpider ID22376541

More details:






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

9-(5-O-{[(5-Amino-6-oxohexyl)amino](hydroxy)phosphoryl}pentofuranosyl)-9H-purin-6-amin [German] [ACD/IUPAC Name]
9-(5-O-{[(5-Amino-6-oxohexyl)amino](hydroxy)phosphoryl}pentofuranosyl)-9H-purin-6-amine [ACD/IUPAC Name]
9-(5-O-{[(5-Amino-6-oxohexyl)amino](hydroxy)phosphoryl}pentofuranosyl)-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-[5-O-[[(5-amino-6-oxohexyl)amino]hydroxyphosphinyl]pentofuranosyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.9±0.1 g/cm3
Boiling Point: 793.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.0±3.0 kJ/mol
Flash Point: 433.5±35.7 °C
Index of Refraction: 1.767
Molar Refractivity: 102.5±0.5 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: -1.93
ACD/LogD (pH 5.5): -5.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 231 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 95.8±7.0 dyne/cm
Molar Volume: 247.4±7.0 cm3

Click to predict properties on the Chemicalize site






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