ChemSpider 2D Image | 2'-O-(4-Azido-2-nitrobenzoyl)adenosine 5'-(tetrahydrogen triphosphate) | C17H18N9O16P3

2'-O-(4-Azido-2-nitrobenzoyl)adenosine 5'-(tetrahydrogen triphosphate)

  • Molecular FormulaC17H18N9O16P3
  • Average mass697.297 Da
  • Monoisotopic mass697.008423 Da
  • ChemSpider ID170127
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

2'-O-(4-Azido-2-nitrobenzoyl)adenosin5'-(tetrahydrogentriphosphat) [German] [ACD/IUPAC Name]
2'-O-(4-Azido-2-nitrobenzoyl)adenosine 5'-(tetrahydrogen triphosphate) [ACD/IUPAC Name]
2'-O-(4-Azido-2-nitrobenzoyl)adénosine-5'-(tétrahydrogène triphosphate) [French] [ACD/IUPAC Name]
Adenosine, 2'-(4-azido-2-nitrobenzoate) 5'-(tetrahydrogen triphosphate) [ACD/Index Name]
3'(2')-O-(2-Nitro-4-azidobenzoyl)adenosine 5'-triphosphate
99308-34-6 [RN]
Nab-ATP

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 25
#H bond donors: 7
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: -1.79
ACD/LogD (pH 5.5): -8.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 373 Å2
Polarizability:
Surface Tension:
Molar Volume:

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