ChemSpider 2D Image | 5'-{[(2-Chloroethyl)carbamoyl](nitroso)amino}-5'-deoxythymidine | C13H18ClN5O6

5'-{[(2-Chloroethyl)carbamoyl](nitroso)amino}-5'-deoxythymidine

  • Molecular FormulaC13H18ClN5O6
  • Average mass375.765 Da
  • Monoisotopic mass375.094574 Da
  • ChemSpider ID34242174

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

5'-{[(2-Chlorethyl)carbamoyl](nitroso)amino}-5'-desoxythymidin [German] [ACD/IUPAC Name]
5'-{[(2-Chloroethyl)carbamoyl](nitroso)amino}-5'-deoxythymidine [ACD/IUPAC Name]
5'-{[(2-Chloroéthyl)carbamoyl](nitroso)amino}-5'-désoxythymidine [French] [ACD/IUPAC Name]
Thymidine, 5'-[[[(2-chloroethyl)amino]carbonyl]nitrosoamino]-5'-deoxy- [ACD/Index Name]
65174-29-0 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.687
Molar Refractivity: 84.5±0.5 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -0.49
ACD/LogD (pH 5.5): -0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.41
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.28
Polar Surface Area: 141 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 70.5±7.0 dyne/cm
Molar Volume: 221.9±7.0 cm3

Click to predict properties on the Chemicalize site


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