ChemSpider 2D Image | N-(4-Butylphenyl)-2'-deoxyguanosine 5'-(tetrahydrogen triphosphate) | C20H28N5O13P3

N-(4-Butylphenyl)-2'-deoxyguanosine 5'-(tetrahydrogen triphosphate)

  • Molecular FormulaC20H28N5O13P3
  • Average mass639.383 Da
  • Monoisotopic mass639.089661 Da
  • ChemSpider ID110286

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

87782-05-6 [RN]
Guanosine, N-(4-butylphenyl)-2'-deoxy-, 5'-(tetrahydrogen triphosphate) [ACD/Index Name]
N-(4-Butylphenyl)-2'-deoxyguanosine 5'-(tetrahydrogen triphosphate) [ACD/IUPAC Name]
N-(4-Butylphenyl)-2'-desoxyguanosin5'-(tetrahydrogentriphosphat) [German] [ACD/IUPAC Name]
N-(4-Butylphényl)-2'-désoxyguanosine-5'-(tétrahydrogène triphosphate) [French] [ACD/IUPAC Name]
BUPDGTP
butylphenyl dGTP
Guanosine 5'-(tetrahydrogen triphosphate), N-(4-butylphenyl)-2'-deoxy-
N(2)-(4-n-butylphenyl)-2'-deoxyguanosine 5'-triphosphate
N(2)-(4-n-Butylphenyl)-2'-deoxyguanosine-5'-triphosphate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.9±0.1 g/cm3
Boiling Point: 953.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 145.4±3.0 kJ/mol
Flash Point: 530.5±37.1 °C
Index of Refraction: 1.745
Molar Refractivity: 134.3±0.5 cm3
#H bond acceptors: 18
#H bond donors: 7
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: -2.70
ACD/LogD (pH 5.5): -8.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 290 Å2
Polarizability: 53.2±0.5 10-24cm3
Surface Tension: 103.8±7.0 dyne/cm
Molar Volume: 331.3±7.0 cm3

Click to predict properties on the Chemicalize site


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