ChemSpider 2D Image | Hexacyclo[11.6.2.1~2,9~.0~3,8~.0~10,20~.0~17,21~]docosa-1(20),2(22),3,5,7,9,11,13,15,17(21),18-undecaene | C22H12

Hexacyclo[11.6.2.12,9.03,8.010,20.017,21]docosa-1(20),2(22),3,5,7,9,11,13,15,17(21),18-undecaene

  • Molecular FormulaC22H12
  • Average mass276.331 Da
  • Monoisotopic mass276.093903 Da
  • ChemSpider ID29317274

More details:

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

6,11-Metheno-11H-benzo[cd]pleiadene [ACD/Index Name]
Hexacyclo[11.6.2.12,9.03,8.010,20.017,21]docosa-1(20),2(22),3,5,7,9,11,13,15,17(21),18-undecaen [German] [ACD/IUPAC Name]
Hexacyclo[11.6.2.12,9.03,8.010,20.017,21]docosa-1(20),2(22),3,5,7,9,11,13,15,17(21),18-undecaene [ACD/IUPAC Name]
Hexacyclo[11.6.2.12,9.03,8.010,20.017,21]docosa-1(20),2(22),3,5,7,9,11,13,15,17(21),18-undécaène [French] [ACD/IUPAC Name]
indeno(1,2,3)pyrene
Indeno[1,2,3]pyrene

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

Density: 1.4±0.1 g/cm3
Boiling Point: 398.9±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.4 mmHg at 25°C
Enthalpy of Vaporization: 62.4±0.8 kJ/mol
Flash Point: 188.6±12.8 °C
Index of Refraction: 2.076
Molar Refractivity: 105.1±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 6.89
ACD/LogD (pH 5.5): 6.62
ACD/BCF (pH 5.5): 62821.95
ACD/KOC (pH 5.5): 94638.85
ACD/LogD (pH 7.4): 6.62
ACD/BCF (pH 7.4): 62821.95
ACD/KOC (pH 7.4): 94638.85
Polar Surface Area: 0 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 74.2±3.0 dyne/cm
Molar Volume: 200.4±3.0 cm3

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