ChemSpider 2D Image | 5-Bromo-2'-deoxycytidine | C9H12BrN3O4

5-Bromo-2'-deoxycytidine

  • Molecular FormulaC9H12BrN3O4
  • Average mass306.113 Da
  • Monoisotopic mass305.001099 Da
  • ChemSpider ID35518620

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

5-Brom-2'-desoxycytidin [German] [ACD/IUPAC Name]
5-Bromo-2'-deoxycytidine [ACD/IUPAC Name]
5-Bromo-2'-désoxycytidine [French] [ACD/IUPAC Name]
Cytidine, 5-bromo-2'-deoxy- [ACD/Index Name]
1022-79-3 [RN]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 510.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 90.0±6.0 kJ/mol
Flash Point: 262.7±32.9 °C
Index of Refraction: 1.764
Molar Refractivity: 59.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.98
ACD/LogD (pH 5.5): -1.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.49
ACD/LogD (pH 7.4): -1.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.49
Polar Surface Area: 108 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 82.4±7.0 dyne/cm
Molar Volume: 143.7±7.0 cm3

Click to predict properties on the Chemicalize site


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