ChemSpider 2D Image | 6-Sulfanyl-9H-purin-9-yl 2,3,5-tri-O-acetyl-beta-D-ribofuranoside | C16H18N4O8S

6-Sulfanyl-9H-purin-9-yl 2,3,5-tri-O-acetyl-β-D-ribofuranoside

  • Molecular FormulaC16H18N4O8S
  • Average mass426.401 Da
  • Monoisotopic mass426.084534 Da
  • ChemSpider ID57422699

  • 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-acétyl-β-D-ribofuranoside de 6-sulfanyl-9H-purin-9-yle [French] [ACD/IUPAC Name]
6-Sulfanyl-9H-purin-9-yl 2,3,5-tri-O-acetyl-β-D-ribofuranoside [ACD/IUPAC Name]
6-Sulfanyl-9H-purin-9-yl-2,3,5-tri-O-acetyl-β-D-ribofuranosid [German] [ACD/IUPAC Name]
β-D-Ribofuranoside, 6-mercapto-9H-purin-9-yl, 2,3,5-triacetate [ACD/Index Name]
(2R,3R,4R,5S)-2-(Acetoxymethyl)-5-((6-mercapto-9H-purin-9-yl)oxy)tetrahydrofuran-3,4-diyl diacetate
3021-21-4 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 579.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.7±3.0 kJ/mol
Flash Point: 304.4±32.9 °C
Index of Refraction: 1.679
Molar Refractivity: 98.0±0.5 cm3
#H bond acceptors: 12
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 0.11
ACD/LogD (pH 5.5): -2.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 180 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 59.1±7.0 dyne/cm
Molar Volume: 259.8±7.0 cm3

Click to predict properties on the Chemicalize site


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