ChemSpider 2D Image | 2-hydroxy-ATP | C10H16N5O14P3

2-hydroxy-ATP

  • Molecular FormulaC10H16N5O14P3
  • Average mass523.180 Da
  • Monoisotopic mass522.990662 Da
  • ChemSpider ID28532829

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2-hydroxy-ATP
2-Oxo-2-hydroadenosin5'-(tetrahydrogentriphosphat) [German] [ACD/IUPAC Name]
2-Oxo-2-hydroadenosine 5'-(tetrahydrogen triphosphate) [ACD/IUPAC Name]
2-Oxo-2-hydroadénosine-5'-(tétrahydrogène triphosphate) [French] [ACD/IUPAC Name]
Adenosine, 2-hydroxy-, 5'-(tetrahydrogen triphosphate) [ACD/Index Name]
2-hydroxyadenosine 5'-triphosphate
2-OH-ATP
  • Miscellaneous

    • Chemical Class:

      A purine ribonucleoside 5'-triphosphate that is ATP in which position 2 on the adenine moiety is substituted by a hydroxy group. ChEBI CHEBI:65119

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

Density: 2.8±0.1 g/cm3
Boiling Point: 1069.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 164.2±3.0 kJ/mol
Flash Point: 600.6±37.1 °C
Index of Refraction: 1.936
Molar Refractivity: 90.7±0.5 cm3
#H bond acceptors: 19
#H bond donors: 9
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -5.98
ACD/LogD (pH 5.5): -11.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -12.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 329 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 215.8±7.0 dyne/cm
Molar Volume: 189.6±7.0 cm3

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