ChemSpider 2D Image | 9-(5-O-{[(2E)-2-Buten-1-yloxy](hydroxy)phosphoryl}-2-O-[dimethyl(2-methyl-2-propanyl)silyl]-beta-D-ribofuranosyl)-2-{(E)-[(dimethylamino)methylene]amino}-9H-purine | C23H39N6O7PSi

9-(5-O-{[(2E)-2-Buten-1-yloxy](hydroxy)phosphoryl}-2-O-[dimethyl(2-methyl-2-propanyl)silyl]-β-D-ribofuranosyl)-2-{(E)-[(dimethylamino)methylene]amino}-9H-purine

  • Molecular FormulaC23H39N6O7PSi
  • Average mass570.651 Da
  • Monoisotopic mass570.238708 Da
  • ChemSpider ID7863504

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

9-(5-O-{[(2E)-2-Buten-1-yloxy](hydroxy)phosphoryl}-2-O-[dimethyl(2-methyl-2-propanyl)silyl]-β-D-ribofuranosyl)-2-{(E)-[(dimethylamino)methylen]amino}-9H-purin [German] [ACD/IUPAC Name]
9-(5-O-{[(2E)-2-Buten-1-yloxy](hydroxy)phosphoryl}-2-O-[dimethyl(2-methyl-2-propanyl)silyl]-β-D-ribofuranosyl)-2-{(E)-[(dimethylamino)methylene]amino}-9H-purine [ACD/IUPAC Name]
9-(5-O-{[(2E)-2-Butén-1-yloxy](hydroxy)phosphoryl}-2-O-[diméthyl(2-méthyl-2-propanyl)silyl]-β-D-ribofuranosyl)-2-{(E)-[(diméthylamino)méthylène]amino}-9H-purine [French] [ACD/IUPAC Name]
9H-Purin-2-amine, 9-[5-O-[[(2E)-2-buten-1-yloxy]hydroxyphosphinyl]-2-O-[(1,1-dimethylethyl)dimethylsilyl]-β-D-ribofuranosyl]-N-[(1E)-(dimethylamino)methylene]- [ACD/Index Name]
126922-67-6 [RN]
2'-Tbdms-dmfg

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

Density: 1.3±0.1 g/cm3
Boiling Point: 687.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.8±3.0 kJ/mol
Flash Point: 369.5±34.3 °C
Index of Refraction: 1.580
Molar Refractivity: 144.2±0.5 cm3
#H bond acceptors: 13
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 2.18
ACD/LogD (pH 5.5): -1.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 163 Å2
Polarizability: 57.2±0.5 10-24cm3
Surface Tension: 44.8±7.0 dyne/cm
Molar Volume: 433.0±7.0 cm3

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