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ChemSpider 2D Image | 5'-O-(Hydroxy{[hydroxy(oxido)phosphoranyl]oxy}phosphoryl)adenosine 2'-(dihydrogen phosphate) | C10H16N5O12P3

5'-O-(Hydroxy{[hydroxy(oxido)phosphoranyl]oxy}phosphoryl)adenosine 2'-(dihydrogen phosphate)

  • Molecular FormulaC10H16N5O12P3
  • Average mass491.182 Da
  • Monoisotopic mass491.000824 Da
  • ChemSpider ID61714949
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

5'-O-(Hydroxy{[hydroxy(oxido)phosphoranyl]oxy}phosphoryl)adenosin2'-(dihydrogenphosphat) [German] [ACD/IUPAC Name]
5'-O-(Hydroxy{[hydroxy(oxido)phosphoranyl]oxy}phosphoryl)adenosine 2'-(dihydrogen phosphate) [ACD/IUPAC Name]
5'-O-(Hydroxy{[hydroxy(oxydo)phosphoranyl]oxy}phosphoryl)adénosine-2'-(dihydrogène phosphate) [French] [ACD/IUPAC Name]
5'-O-[(S)-Hydroxy{[hydroxy(oxido)phosphoranyl]oxy}phosphoryl]adenosin2'-(dihydrogenphosphat) [German] [ACD/IUPAC Name]
5'-O-[(S)-Hydroxy{[hydroxy(oxido)phosphoranyl]oxy}phosphoryl]adenosine 2'-(dihydrogen phosphate) [ACD/IUPAC Name]
5'-O-[(S)-Hydroxy{[hydroxy(oxydo)phosphoranyl]oxy}phosphoryl]adénosine-2'-(dihydrogène phosphate) [French] [ACD/IUPAC Name]
Adenosine, 5'-O-[(S)-hydroxy[(hydroxyphosphinyl)oxy]phosphinyl]-, 2'-(dihydrogen phosphate) [ACD/Index Name]
Adenosine, 5'-O-[hydroxy[(hydroxyphosphinyl)oxy]phosphinyl]-, 2'-(dihydrogen phosphate) [ACD/Index Name]
NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
NAP

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

Density:
Boiling Point: 944.9±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 144.1±3.0 kJ/mol
Flash Point: 525.2±37.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 17
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -4.98
ACD/LogD (pH 5.5): -10.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -11.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 302 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






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