ChemSpider 2D Image | 2',3',5'-Tri-O-acetyl-2-[(2E)-3-(benzylcarbamoyl)-2-triazen-1-yl]adenosine | C24H27N9O8

2',3',5'-Tri-O-acetyl-2-[(2E)-3-(benzylcarbamoyl)-2-triazen-1-yl]adenosine

  • Molecular FormulaC24H27N9O8
  • Average mass569.527 Da
  • Monoisotopic mass569.198242 Da
  • ChemSpider ID9988455

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2',3',5'-Tri-O-acetyl-2-[(2E)-3-(benzylcarbamoyl)-2-triazen-1-yl]adenosin [German] [ACD/IUPAC Name]
2',3',5'-Tri-O-acetyl-2-[(2E)-3-(benzylcarbamoyl)-2-triazen-1-yl]adenosine [ACD/IUPAC Name]
2',3',5'-Tri-O-acétyl-2-[(2E)-3-(benzylcarbamoyl)-2-triazén-1-yl]adénosine [French] [ACD/IUPAC Name]
Adenosine, 2-[(2E)-3-[[(phenylmethyl)amino]carbonyl]-2-triazen-1-yl]-, 2',3',5'-triacetate [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.704
Molar Refractivity: 138.6±0.5 cm3
#H bond acceptors: 17
#H bond donors: 4
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 1.16
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 8.94
ACD/KOC (pH 5.5): 166.98
ACD/LogD (pH 7.4): 1.55
ACD/BCF (pH 7.4): 8.95
ACD/KOC (pH 7.4): 167.10
Polar Surface Area: 224 Å2
Polarizability: 55.0±0.5 10-24cm3
Surface Tension: 66.1±7.0 dyne/cm
Molar Volume: 357.1±7.0 cm3

Click to predict properties on the Chemicalize site


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