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Search term: Nc1nc(=O)n(cc1O)[C@H]1C[C@H](O)[C@@H](COP(O)(O)=O)O1 (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | 2'-Deoxy-5-hydroxycytidine 5'-(dihydrogen phosphate) | C9H14N3O8P

2'-Deoxy-5-hydroxycytidine 5'-(dihydrogen phosphate)

  • Molecular FormulaC9H14N3O8P
  • Average mass323.197 Da
  • Monoisotopic mass323.051849 Da
  • ChemSpider ID59052873

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

2'-Deoxy-5-hydroxycytidine 5'-(dihydrogen phosphate) [ACD/IUPAC Name]
2'-Desoxy-5-hydroxycytidin5'-(dihydrogenphosphat) [German] [ACD/IUPAC Name]
2'-Désoxy-5-hydroxycytidine-5'-(dihydrogène phosphate) [French] [ACD/IUPAC Name]
Cytidine, 2'-deoxy-5-hydroxy-, 5'-(dihydrogen phosphate) [ACD/Index Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 668.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.6 mmHg at 25°C
Enthalpy of Vaporization: 112.5±6.0 kJ/mol
Flash Point: 358.4±34.3 °C
Index of Refraction: 1.775
Molar Refractivity: 62.6±0.5 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -2.23
ACD/LogD (pH 5.5): -7.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 185 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 121.6±7.0 dyne/cm
Molar Volume: 150.0±7.0 cm3

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