ChemSpider 2D Image | 3'-O-{[5-(Dimethylamino)-1-naphthyl]sulfonyl}adenosine | C22H24N6O6S

3'-O-{[5-(Dimethylamino)-1-naphthyl]sulfonyl}adenosine

  • Molecular FormulaC22H24N6O6S
  • Average mass500.528 Da
  • Monoisotopic mass500.147797 Da
  • ChemSpider ID169896

  • 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-naphthyl]sulfonyl}adenosin [German] [ACD/IUPAC Name]
3'-O-{[5-(Dimethylamino)-1-naphthyl]sulfonyl}adenosine [ACD/IUPAC Name]
3'-O-{[5-(Diméthylamino)-1-naphtyl]sulfonyl}adénosine [French] [ACD/IUPAC Name]
Adenosine, 3'-O-[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]- [ACD/Index Name]
3'-O-(5-(Dimethylamino)naphthalene-1-sulfonyl)adenosine
3'-O-Dansyladenosine
77446-71-0 [RN]
Adenosine, 3'-(5-(dimethylamino)-1-naphthalenesulfonate)

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

Density: 1.7±0.1 g/cm3
Boiling Point: 821.3±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.1±3.0 kJ/mol
Flash Point: 450.5±37.1 °C
Index of Refraction: 1.757
Molar Refractivity: 124.0±0.5 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 2.33
ACD/LogD (pH 5.5): 1.63
ACD/BCF (pH 5.5): 10.08
ACD/KOC (pH 5.5): 179.65
ACD/LogD (pH 7.4): 1.65
ACD/BCF (pH 7.4): 10.52
ACD/KOC (pH 7.4): 187.59
Polar Surface Area: 174 Å2
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 71.9±7.0 dyne/cm
Molar Volume: 302.3±7.0 cm3

Click to predict properties on the Chemicalize site


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