ChemSpider 2D Image | Adenosine 5'-(tetrahydrogen triphosphate) 3'-(trihydrogen diphosphate) | C10H18N5O19P5

Adenosine 5'-(tetrahydrogen triphosphate) 3'-(trihydrogen diphosphate)

  • Molecular FormulaC10H18N5O19P5
  • Average mass667.141 Da
  • Monoisotopic mass666.928406 Da
  • ChemSpider ID4955333

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

Adenosin-5'-(tetrahydrogentriphosphat)-3'-(trihydrogendiphosphat) [German] [ACD/IUPAC Name]
Adenosine 5'-(tetrahydrogen triphosphate) 3'-(trihydrogen diphosphate) [ACD/IUPAC Name]
Adenosine, 5'-(tetrahydrogen triphosphate) 3'-(trihydrogen diphosphate) [ACD/Index Name]
Adénosine-5'-(tétrahydrogène triphosphate) 3'-(trihydrogène diphosphate) [French] [ACD/IUPAC Name]
53951-06-7 [RN]
Adenosine 5'-(tetrahydrogen triphosphate), 3'-(trihydrogen diphosphate)
Adenosine 5'-triphosphate 3'-diphosphate
Pppapp

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

Density: 2.8±0.1 g/cm3
Boiling Point: 1123.7±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 173.3±3.0 kJ/mol
Flash Point: 633.4±37.1 °C
Index of Refraction: 1.905
Molar Refractivity: 109.7±0.5 cm3
#H bond acceptors: 24
#H bond donors: 10
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: -7.16
ACD/LogD (pH 5.5): -15.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -17.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 421 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 241.9±7.0 dyne/cm
Molar Volume: 235.0±7.0 cm3

Click to predict properties on the Chemicalize site


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