ChemSpider 2D Image | 3,3''''',4,4''''',5,5'''''-Hexafluoro-1,1':4',1'':2'',1''':2''',1'''':4'''',1'''''-sexiphenyl-4''',5''-diamine | C36H22F6N2

3,3''''',4,4''''',5,5'''''-Hexafluoro-1,1':4',1'':2'',1''':2''',1'''':4'''',1'''''-sexiphenyl-4''',5''-diamine

  • Molecular FormulaC36H22F6N2
  • Average mass596.564 Da
  • Monoisotopic mass596.168701 Da
  • ChemSpider ID30653738

More details:

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

[1,1':4',1'':2'',1''':2''',1'''':4'''',1'''''-Sexiphenyl]-4''',5''-diamine, 3,3''''',4,4''''',5,5'''''-hexafluoro- [ACD/Index Name]
3,3''''',4,4''''',5,5'''''-Hexafluor-1,1':4',1'':2'',1''':2''',1'''':4'''',1'''''-sexiphenyl-4''',5''-diamin [German] [ACD/IUPAC Name]
3,3''''',4,4''''',5,5'''''-Hexafluoro-1,1':4',1'':2'',1''':2''',1'''':4'''',1'''''-sexiphenyl-4''',5''-diamine [ACD/IUPAC Name]
3,3''''',4,4''''',5,5'''''-Hexafluoro-1,1':4',1'':2'',1''':2''',1'''':4'''',1'''''-sexiphényl-4''',5''-diamine [French] [ACD/IUPAC 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: 683.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.2±3.0 kJ/mol
Flash Point: 299.0±22.2 °C
Index of Refraction: 1.625
Molar Refractivity: 157.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 6.59
ACD/LogD (pH 5.5): 7.06
ACD/BCF (pH 5.5): 135800.14
ACD/KOC (pH 5.5): 162336.55
ACD/LogD (pH 7.4): 7.08
ACD/BCF (pH 7.4): 141670.50
ACD/KOC (pH 7.4): 169354.03
Polar Surface Area: 52 Å2
Polarizability: 62.5±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 445.7±3.0 cm3

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