ChemSpider 2D Image | 6,11-Dihydroxy-8-[(1S)-1-hydroxyethyl]-1-methoxy-5,12-tetracenedione | C21H16O6

6,11-Dihydroxy-8-[(1S)-1-hydroxyethyl]-1-methoxy-5,12-tetracenedione

  • Molecular FormulaC21H16O6
  • Average mass364.348 Da
  • Monoisotopic mass364.094696 Da
  • ChemSpider ID59701535

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

5,12-Naphthacenedione, 6,11-dihydroxy-8-[(1S)-1-hydroxyethyl]-1-methoxy- [ACD/Index Name]
6,11-Dihydroxy-8-[(1S)-1-hydroxyethyl]-1-methoxy-5,12-tetracendion [German] [ACD/IUPAC Name]
6,11-Dihydroxy-8-[(1S)-1-hydroxyethyl]-1-methoxy-5,12-tetracenedione [ACD/IUPAC Name]
6,11-Dihydroxy-8-[(1S)-1-hydroxyéthyl]-1-méthoxy-5,12-tétracènedione [French] [ACD/IUPAC Name]
Daunomycinone, bisanhydro-13-dihydro

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

Density: 1.5±0.1 g/cm3
Boiling Point: 666.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 103.0±3.0 kJ/mol
Flash Point: 243.0±25.0 °C
Index of Refraction: 1.732
Molar Refractivity: 98.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.83
ACD/LogD (pH 5.5): 4.37
ACD/BCF (pH 5.5): 1223.41
ACD/KOC (pH 5.5): 5628.56
ACD/LogD (pH 7.4): 4.10
ACD/BCF (pH 7.4): 667.76
ACD/KOC (pH 7.4): 3072.15
Polar Surface Area: 104 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 75.3±3.0 dyne/cm
Molar Volume: 245.1±3.0 cm3

Click to predict properties on the Chemicalize site


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