ChemSpider 2D Image | 3'-O-(5-Fluoro-2,4-dinitrophenyl)adenosine 5'-(tetrahydrogen triphosphate) | C16H17FN7O17P3

3'-O-(5-Fluoro-2,4-dinitrophenyl)adenosine 5'-(tetrahydrogen triphosphate)

  • Molecular FormulaC16H17FN7O17P3
  • Average mass691.263 Da
  • Monoisotopic mass690.987793 Da
  • ChemSpider ID2340209

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

3'-O-(5-Fluor-2,4-dinitrophenyl)adenosin5'-(tetrahydrogentriphosphat) [German] [ACD/IUPAC Name]
3'-O-(5-Fluoro-2,4-dinitrophenyl)adenosine 5'-(tetrahydrogen triphosphate) [ACD/IUPAC Name]
3'-O-(5-Fluoro-2,4-dinitrophényl)adénosine-5'-(tétrahydrogène triphosphate) [French] [ACD/IUPAC Name]
Adenosine, 3'-O-(5-fluoro-2,4-dinitrophenyl)-, 5'-(tetrahydrogen triphosphate) [ACD/Index Name]
117414-71-8 [RN]
3'(O)-(5-Fluoro-2,4-dinitrophenyl)adenosine triphosphate ether
3'-O-(5-Fluoro-2,4-dinitrophenyl)ATP ether
Adenosine 5'-(tetrahydrogen triphosphate), 3'-O-(5-fluoro-2,4-dinitrophenyl)-
Fdnp-atpe

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

Density: 2.4±0.1 g/cm3
Boiling Point: 1071.6±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 164.6±3.0 kJ/mol
Flash Point: 601.9±37.1 °C
Index of Refraction: 1.854
Molar Refractivity: 126.6±0.5 cm3
#H bond acceptors: 24
#H bond donors: 7
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: -3.54
ACD/LogD (pH 5.5): -9.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 389 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 158.6±7.0 dyne/cm
Molar Volume: 282.5±7.0 cm3

Click to predict properties on the Chemicalize site


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