ChemSpider 2D Image | 3'-O-[5-(Dimethylamino)-1-naphthoyl]adenosine 5'-(tetrahydrogen triphosphate) | C23H27N6O14P3

3'-O-[5-(Dimethylamino)-1-naphthoyl]adenosine 5'-(tetrahydrogen triphosphate)

  • Molecular FormulaC23H27N6O14P3
  • Average mass704.414 Da
  • Monoisotopic mass704.079834 Da
  • ChemSpider ID57523222

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

3'-O-[5-(Dimethylamino)-1-naphthoyl]adenosin5'-(tetrahydrogentriphosphat) [German] [ACD/IUPAC Name]
3'-O-[5-(Dimethylamino)-1-naphthoyl]adenosine 5'-(tetrahydrogen triphosphate) [ACD/IUPAC Name]
3'-O-[5-(Diméthylamino)-1-naphtoyl]adénosine-5'-(tétrahydrogène triphosphate) [French] [ACD/IUPAC Name]
Adenosine, 3'-O-[[5-(dimethylamino)-1-naphthalenyl]carbonyl]-, 5'-(tetrahydrogen triphosphate) [ACD/Index Name]
5-(dimethylamino-1-naphthoyl)adenosine triphosphate
72947-54-7 [RN]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 1004.3±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 153.5±3.0 kJ/mol
Flash Point: 561.2±37.1 °C
Index of Refraction: 1.772
Molar Refractivity: 149.6±0.5 cm3
#H bond acceptors: 20
#H bond donors: 7
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: -0.49
ACD/LogD (pH 5.5): -8.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 318 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 105.7±7.0 dyne/cm
Molar Volume: 359.2±7.0 cm3

Click to predict properties on the Chemicalize site


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