ChemSpider 2D Image | (7S,9S)-9-acetyl-6,9,11-trihydroxy-4-methoxy-7-tetrahydropyran-2-yloxy-8,10-dihydro-7H-tetracene-5,12-dione | C26H26O9

(7S,9S)-9-acetyl-6,9,11-trihydroxy-4-methoxy-7-tetrahydropyran-2-yloxy-8,10-dihydro-7H-tetracene-5,12-dione

  • Molecular FormulaC26H26O9
  • Average mass482.479 Da
  • Monoisotopic mass482.157684 Da
  • ChemSpider ID58782364

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

(8S,10S)-8-Acetyl-6,8,11-trihydroxy-1-methoxy-10-(tetrahydro-2H-pyran-2-yloxy)-7,8,9,10-tetrahydro-5,12-tetracendion [German] [ACD/IUPAC Name]
(8S,10S)-8-Acétyl-6,8,11-trihydroxy-1-méthoxy-10-(tétrahydro-2H-pyran-2-yloxy)-7,8,9,10-tétrahydro-5,12-tétracènedione [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 704.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 108.2±3.0 kJ/mol
Flash Point: 239.7±26.4 °C
Index of Refraction: 1.673
Molar Refractivity: 120.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 219.13
ACD/KOC (pH 5.5): 1637.33
ACD/LogD (pH 7.4): 2.92
ACD/BCF (pH 7.4): 74.36
ACD/KOC (pH 7.4): 555.63
Polar Surface Area: 140 Å2
Polarizability: 47.7±0.5 10-24cm3
Surface Tension: 79.2±5.0 dyne/cm
Molar Volume: 320.8±5.0 cm3

Click to predict properties on the Chemicalize site


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