ChemSpider 2D Image | 11,13-Dihydroxy-8-methoxy-4-methyl-4,5,6,7,8,9-hexahydro-2H-3-benzoxacyclododecine-2,10(1H)-dione | C17H22O6

11,13-Dihydroxy-8-methoxy-4-methyl-4,5,6,7,8,9-hexahydro-2H-3-benzoxacyclododecine-2,10(1H)-dione

  • Molecular FormulaC17H22O6
  • Average mass322.353 Da
  • Monoisotopic mass322.141632 Da
  • ChemSpider ID22369746

More details:

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

11,13-Dihydroxy-8-methoxy-4-methyl-4,5,6,7,8,9-hexahydro-2H-3-benzoxacyclododecin-2,10(1H)-dion [German] [ACD/IUPAC Name]
11,13-Dihydroxy-8-methoxy-4-methyl-4,5,6,7,8,9-hexahydro-2H-3-benzoxacyclododecine-2,10(1H)-dione [ACD/IUPAC Name]
11,13-Dihydroxy-8-méthoxy-4-méthyl-4,5,6,7,8,9-hexahydro-2H-3-benzoxacyclododécine-2,10(1H)-dione [French] [ACD/IUPAC Name]
2H-3-Benzoxacyclododecin-2,10(1H)-dione, 4,5,6,7,8,9-hexahydro-11,13-dihydroxy-8-methoxy-4-methyl- [ACD/Index Name]
13,15-Dihydroxy-9-methoxy-5-methyl-4-oxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-3,11-dione
Compound NP-005331

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

Density: 1.3±0.1 g/cm3
Boiling Point: 570.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 208.4±23.6 °C
Index of Refraction: 1.566
Molar Refractivity: 82.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.13
ACD/LogD (pH 5.5): 2.81
ACD/BCF (pH 5.5): 79.79
ACD/KOC (pH 5.5): 796.24
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 34.78
ACD/KOC (pH 7.4): 347.05
Polar Surface Area: 93 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 55.8±5.0 dyne/cm
Molar Volume: 252.6±5.0 cm3

Click to predict properties on the Chemicalize site


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