ChemSpider 2D Image | 3-Methoxy-6,7,10,11-tetrakis(pentyloxy)-2-triphenylenol | C39H54O6

3-Methoxy-6,7,10,11-tetrakis(pentyloxy)-2-triphenylenol

  • Molecular FormulaC39H54O6
  • Average mass618.843 Da
  • Monoisotopic mass618.392029 Da
  • ChemSpider ID8501985

More details:

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

2-Triphenylenol, 3-methoxy-6,7,10,11-tetrakis(pentyloxy)- [ACD/Index Name]
3-Methoxy-6,7,10,11-tetrakis(pentyloxy)-2-triphenylenol [ACD/IUPAC Name]
3-Methoxy-6,7,10,11-tetrakis(pentyloxy)-2-triphenylenol [German] [ACD/IUPAC Name]
3-Méthoxy-6,7,10,11-tétrakis(pentyloxy)-2-triphénylénol [French] [ACD/IUPAC Name]
168847-16-3 [RN]
2-hydroxy-3-methoxy-6,7,10,11-tetrakis-pentyloxy triphenylene
3-METHOXY-6,7,10,11-TETRAKIS(PENTYLOXY)TRIPHENYLEN-2-OL

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

Density: 1.1±0.1 g/cm3
Boiling Point: 733.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.8±3.0 kJ/mol
Flash Point: 397.2±31.5 °C
Index of Refraction: 1.573
Molar Refractivity: 189.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 2
ACD/LogP: 12.85
ACD/LogD (pH 5.5): 11.91
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.91
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 66 Å2
Polarizability: 75.0±0.5 10-24cm3
Surface Tension: 41.0±3.0 dyne/cm
Molar Volume: 574.3±3.0 cm3

Click to predict properties on the Chemicalize site


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