ChemSpider 2D Image | 2,9,16,23-Tetraisopropyl-5,6,11,12,13,14,19,20,25,26,27,28-dodecadehydrotetrabenzo[a,e,k,o][20]annulene | C48H40

2,9,16,23-Tetraisopropyl-5,6,11,12,13,14,19,20,25,26,27,28-dodecadehydrotetrabenzo[a,e,k,o][20]annulene

  • Molecular FormulaC48H40
  • Average mass616.831 Da
  • Monoisotopic mass616.312988 Da
  • ChemSpider ID30657253

More details:

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

2,9,16,23-Tetraisopropyl-5,6,11,12,13,14,19,20,25,26,27,28-dodecadehydrotetrabenzo[a,e,k,o][20]annulen [German] [ACD/IUPAC Name]
2,9,16,23-Tetraisopropyl-5,6,11,12,13,14,19,20,25,26,27,28-dodecadehydrotetrabenzo[a,e,k,o][20]annulene [ACD/IUPAC Name]
2,9,16,23-Tétraisopropyl-5,6,11,12,13,14,19,20,25,26,27,28-dodécadéhydrotétrabenzo[a,e,k,o][20]annulène [French] [ACD/IUPAC Name]
Tetrabenzo[a,e,k,o]cycloeicosene, 5,6,11,12,13,14,19,20,25,26,27,28-dodecadehydro-2,9,16,23-tetrakis(1-methylethyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 750.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 105.5±0.8 kJ/mol
Flash Point: 417.9±27.0 °C
Index of Refraction: 1.661
Molar Refractivity: 197.9±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 19.06
ACD/LogD (pH 5.5): 15.55
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 15.55
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 78.5±0.5 10-24cm3
Surface Tension: 61.3±5.0 dyne/cm
Molar Volume: 535.6±5.0 cm3

Click to predict properties on the Chemicalize site


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