ChemSpider 2D Image | 3'-o-acetylthymidine-(5' diphosphate phenyl ester) | C18H22N2O12P2

3'-o-acetylthymidine-(5' diphosphate phenyl ester)

  • Molecular FormulaC18H22N2O12P2
  • Average mass520.321 Da
  • Monoisotopic mass520.064819 Da
  • ChemSpider ID392894

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

3'-O-Acetyl-5'-O-[(R)-hydroxy{[(S)-hydroxy(phenoxy)phosphoryl]oxy}phosphoryl]thymidin [German] [ACD/IUPAC Name]
3'-O-Acetyl-5'-O-[(R)-hydroxy{[(S)-hydroxy(phenoxy)phosphoryl]oxy}phosphoryl]thymidine [ACD/IUPAC Name]
3'-O-Acétyl-5'-O-[(R)-hydroxy{[(S)-hydroxy(phénoxy)phosphoryl]oxy}phosphoryl]thymidine [French] [ACD/IUPAC Name]
3'-o-acetylthymidine-(5' diphosphate phenyl ester)
Thymidine, 5'-O-[(R)-hydroxy[[(S)-hydroxyphenoxyphosphinyl]oxy]phosphinyl]-, 3'-acetate [ACD/Index Name]
TPE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.599
Molar Refractivity: 111.0±0.4 cm3
#H bond acceptors: 14
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: -0.92
ACD/LogD (pH 5.5): -6.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 207 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 73.9±5.0 dyne/cm
Molar Volume: 324.7±5.0 cm3

Click to predict properties on the Chemicalize site


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