ChemSpider 2D Image | 9-{5-O-[{[(2S)-2-Amino-3-hydroxypropanoyl]oxy}(hydroxy)phosphoryl]-alpha-D-ribofuranosyl}-9H-purin-6-amine | C13H19N6O9P

9-{5-O-[{[(2S)-2-Amino-3-hydroxypropanoyl]oxy}(hydroxy)phosphoryl]-α-D-ribofuranosyl}-9H-purin-6-amine

  • Molecular FormulaC13H19N6O9P
  • Average mass434.298 Da
  • Monoisotopic mass434.095123 Da
  • ChemSpider ID88298006

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

9-{5-O-[{[(2S)-2-Amino-3-hydroxypropanoyl]oxy}(hydroxy)phosphoryl]-α-D-ribofuranosyl}-9H-purin-6-amin [German] [ACD/IUPAC Name]
9-{5-O-[{[(2S)-2-Amino-3-hydroxypropanoyl]oxy}(hydroxy)phosphoryl]-α-D-ribofuranosyl}-9H-purin-6-amine [ACD/IUPAC Name]
9-{5-O-[{[(2S)-2-Amino-3-hydroxypropanoyl]oxy}(hydroxy)phosphoryl]-α-D-ribofuranosyl}-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-[5-O-[[(2S)-2-amino-3-hydroxy-1-oxopropoxy]hydroxyphosphinyl]-α-D-ribofuranosyl]- [ACD/Index Name]
52435-67-3 [RN]
L-Seryl-AMP

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

Density: 2.2±0.1 g/cm3
Boiling Point: 851.3±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 129.6±3.0 kJ/mol
Flash Point: 468.7±37.1 °C
Index of Refraction: 1.841
Molar Refractivity: 87.9±0.5 cm3
#H bond acceptors: 15
#H bond donors: 8
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -2.16
ACD/LogD (pH 5.5): -5.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 248 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 125.2±7.0 dyne/cm
Molar Volume: 198.3±7.0 cm3

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