ChemSpider 2D Image | N-(6-Aminohexyl)cytidine 5'-(tetrahydrogen triphosphate) | C15H29N4O14P3

N-(6-Aminohexyl)cytidine 5'-(tetrahydrogen triphosphate)

  • Molecular FormulaC15H29N4O14P3
  • Average mass582.330 Da
  • Monoisotopic mass582.089294 Da
  • ChemSpider ID169425

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

Cytidine, N-(6-aminohexyl)-, 5'-(tetrahydrogen triphosphate) [ACD/Index Name]
N-(6-Aminohexyl)cytidin5'-(tetrahydrogentriphosphat) [German] [ACD/IUPAC Name]
N-(6-Aminohexyl)cytidine 5'-(tetrahydrogen triphosphate) [ACD/IUPAC Name]
N-(6-Aminohexyl)cytidine-5'-(tétrahydrogène triphosphate) [French] [ACD/IUPAC Name]
({[(2R,3S,4R,5R)-5-{4-[(6-AMINOHEXYL)AMINO]-2-OXOPYRIMIDIN-1-YL}-3,4-DIHYDROXYOXOLAN-2-YL]METHOXY(HYDROXY)PHOSPHORYL}OXY(HYDROXY)PHOSPHORYL)OXYPHOSPHONIC ACID
123354-89-2 [RN]
AHCTP
N(4)-(6-Aminohexyl)cytidine 5'-triphosphate

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

Density: 2.0±0.1 g/cm3
Boiling Point: 849.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 140.4±6.0 kJ/mol
Flash Point: 467.7±37.1 °C
Index of Refraction: 1.698
Molar Refractivity: 113.2±0.5 cm3
#H bond acceptors: 18
#H bond donors: 9
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: -5.10
ACD/LogD (pH 5.5): -10.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -11.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 310 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 111.7±7.0 dyne/cm
Molar Volume: 293.7±7.0 cm3

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