ChemSpider 2D Image | 1,2,3-Trimethoxy-5,7-dihydro-6,9,11-trioxabenzo[3,4]cyclohepta[1,2-f]indene | C18H18O6

1,2,3-Trimethoxy-5,7-dihydro-6,9,11-trioxabenzo[3,4]cyclohepta[1,2-f]indene

  • Molecular FormulaC18H18O6
  • Average mass330.332 Da
  • Monoisotopic mass330.110352 Da
  • ChemSpider ID26993534

More details:

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

1,2,3-Trimethoxy-5,7-dihydro-6,9,11-trioxabenzo[3,4]cyclohepta[1,2-f]inden [German] [ACD/IUPAC Name]
1,2,3-Trimethoxy-5,7-dihydro-6,9,11-trioxabenzo[3,4]cyclohepta[1,2-f]indene [ACD/IUPAC Name]
1,2,3-Triméthoxy-5,7-dihydro-6,9,11-trioxabenzo[3,4]cyclohepta[1,2-f]indène [French] [ACD/IUPAC Name]
6,9,11-Trioxabenzo[3,4]cyclohept[1,2-f]indene, 5,7-dihydro-1,2,3-trimethoxy- [ACD/Index Name]
5,7-Dihydro-1,2,3-trimethoxybenzo[d][1,3]dioxolo[4,5-h][2]benzoxepine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 516.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 75.9±3.0 kJ/mol
Flash Point: 219.3±30.0 °C
Index of Refraction: 1.583
Molar Refractivity: 86.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.26
ACD/LogD (pH 5.5): 2.88
ACD/BCF (pH 5.5): 90.11
ACD/KOC (pH 5.5): 872.63
ACD/LogD (pH 7.4): 2.88
ACD/BCF (pH 7.4): 90.11
ACD/KOC (pH 7.4): 872.63
Polar Surface Area: 55 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 258.0±3.0 cm3

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