ChemSpider 2D Image | 1,4,11-Trihydroxy-10-methoxy-5,8-dimethyl-7H-2,6,12-trioxabenzo[5,6]cyclohepta[1,2-e]indene-3,7(1H)-dione | C18H14O9

1,4,11-Trihydroxy-10-methoxy-5,8-dimethyl-7H-2,6,12-trioxabenzo[5,6]cyclohepta[1,2-e]indene-3,7(1H)-dione

  • Molecular FormulaC18H14O9
  • Average mass374.298 Da
  • Monoisotopic mass374.063782 Da
  • ChemSpider ID78434993

More details:

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

1,4,11-Trihydroxy-10-methoxy-5,8-dimethyl-7H-2,6,12-trioxabenzo[5,6]cyclohepta[1,2-e]inden-3,7(1H)-dion [German] [ACD/IUPAC Name]
1,4,11-Trihydroxy-10-methoxy-5,8-dimethyl-7H-2,6,12-trioxabenzo[5,6]cyclohepta[1,2-e]indene-3,7(1H)-dione [ACD/IUPAC Name]
1,4,11-Trihydroxy-10-méthoxy-5,8-diméthyl-7H-2,6,12-trioxabenzo[5,6]cyclohepta[1,2-e]indène-3,7(1H)-dione [French] [ACD/IUPAC Name]
7H-2,6,12-Trioxabenzo[5,6]cyclohept[1,2-e]indene-3,7(1H)-dione, 1,4,11-trihydroxy-10-methoxy-5,8-dimethyl- [ACD/Index Name]
Menegazziaic acid

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

Density: 1.6±0.1 g/cm3
Boiling Point: 744.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.9±3.0 kJ/mol
Flash Point: 275.6±26.4 °C
Index of Refraction: 1.694
Molar Refractivity: 88.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.01
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 6.52
ACD/KOC (pH 5.5): 133.06
ACD/LogD (pH 7.4): 1.32
ACD/BCF (pH 7.4): 5.76
ACD/KOC (pH 7.4): 117.63
Polar Surface Area: 132 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 78.8±3.0 dyne/cm
Molar Volume: 229.4±3.0 cm3

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