ChemSpider 2D Image | 1-Hydroxyadenosine 5'-(tetrahydrogen triphosphate) | C10H16N5O14P3

1-Hydroxyadenosine 5'-(tetrahydrogen triphosphate)

  • Molecular FormulaC10H16N5O14P3
  • Average mass523.180 Da
  • Monoisotopic mass522.990662 Da
  • ChemSpider ID34549481

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1-Hydroxyadenosin5'-(tetrahydrogentriphosphat) [German] [ACD/IUPAC Name]
1-Hydroxyadenosine 5'-(tetrahydrogen triphosphate) [ACD/IUPAC Name]
1-Hydroxyadénosine-5'-(tétrahydrogène triphosphate) [French] [ACD/IUPAC Name]
Adenosine, 1-hydroxy-, 5'-(tetrahydrogen triphosphate) [ACD/Index Name]
17670-17-6 [RN]
Adenosine5'-(tetrahydrogen triphosphate), 1-oxide (8CI,9CI)

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

Density: 2.7±0.1 g/cm3
Boiling Point: 1005.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 153.6±3.0 kJ/mol
Flash Point: 561.7±37.1 °C
Index of Refraction: 1.907
Molar Refractivity: 91.6±0.5 cm3
#H bond acceptors: 19
#H bond donors: 8
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -6.06
ACD/LogD (pH 5.5): -12.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -13.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 316 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 205.6±7.0 dyne/cm
Molar Volume: 195.7±7.0 cm3

Click to predict properties on the Chemicalize site


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