Found 6 results

Search term: MF = 'C_{54}H_{30}'
ChemSpider 2D Image | 1,1'-(1,2-Phenylenedi-2,1-ethynediyl)bis(2-{[2-(phenylethynyl)phenyl]ethynyl}benzene) | C54H30

1,1'-(1,2-Phenylenedi-2,1-ethynediyl)bis(2-{[2-(phenylethynyl)phenyl]ethynyl}benzene)

  • Molecular FormulaC54H30
  • Average mass678.816 Da
  • Monoisotopic mass678.234741 Da
  • ChemSpider ID9414384

More details:

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

1,1'-(1,2-Phenylendi-2,1-ethindiyl)bis(2-{[2-(phenylethinyl)phenyl]ethinyl}benzol) [German] [ACD/IUPAC Name]
1,1'-(1,2-Phenylenedi-2,1-ethynediyl)bis(2-{[2-(phenylethynyl)phenyl]ethynyl}benzene) [ACD/IUPAC Name]
1,1'-(1,2-Phénylènedi-2,1-éthynediyl)bis(2-{[2-(phényléthynyl)phényl]éthynyl}benzène) [French] [ACD/IUPAC Name]
Benzene, 1,2-bis[2-[2-[2-[2-(2-phenylethynyl)phenyl]ethynyl]phenyl]ethynyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 890.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.2 mmHg at 25°C
Enthalpy of Vaporization: 125.0±0.8 kJ/mol
Flash Point: 503.5±28.4 °C
Index of Refraction: 1.753
Molar Refractivity: 218.6±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 17.59
ACD/LogD (pH 5.5): 14.70
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 14.70
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 86.7±0.5 10-24cm3
Surface Tension: 76.6±5.0 dyne/cm
Molar Volume: 534.8±5.0 cm3

Click to predict properties on the Chemicalize site


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