ChemSpider 2D Image | 5'-O-{[(3-Bromo-2-oxopropyl)sulfanyl](hydroxy)phosphoryl}guanosine | C13H17BrN5O8PS

5'-O-{[(3-Bromo-2-oxopropyl)sulfanyl](hydroxy)phosphoryl}guanosine

  • Molecular FormulaC13H17BrN5O8PS
  • Average mass514.245 Da
  • Monoisotopic mass512.971863 Da
  • ChemSpider ID170995

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

5'-O-{[(3-Brom-2-oxopropyl)sulfanyl](hydroxy)phosphoryl}guanosin [German] [ACD/IUPAC Name]
5'-O-{[(3-Bromo-2-oxopropyl)sulfanyl](hydroxy)phosphoryl}guanosine [ACD/IUPAC Name]
5'-O-{[(3-Bromo-2-oxopropyl)sulfanyl](hydroxy)phosphoryl}guanosine [French] [ACD/IUPAC Name]
Guanosine, 5'-O-[[(3-bromo-2-oxopropyl)thio]hydroxyphosphinyl]- [ACD/Index Name]
144085-39-2 [RN]
Gboptp
Guanosine,5'-[S-(3-bromo-2-oxopropyl) hydrogen phosphorothioate] (9CI)
Guanosine-5'-O-(S-(3-bromo-2-oxopropyl))thiophosphate

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

Density: 2.3±0.1 g/cm3
Boiling Point: 883.2±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 134.5±3.0 kJ/mol
Flash Point: 487.9±37.1 °C
Index of Refraction: 1.859
Molar Refractivity: 100.0±0.5 cm3
#H bond acceptors: 13
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 0.15
ACD/LogD (pH 5.5): -4.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 234 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 116.8±7.0 dyne/cm
Molar Volume: 222.1±7.0 cm3

Click to predict properties on the Chemicalize site


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