ChemSpider 2D Image | 3,6-Dibromo-2,7-naphthalenediyl bis(trifluoromethanesulfonate) | C12H4Br2F6O6S2

3,6-Dibromo-2,7-naphthalenediyl bis(trifluoromethanesulfonate)

  • Molecular FormulaC12H4Br2F6O6S2
  • Average mass582.085 Da
  • Monoisotopic mass579.772034 Da
  • ChemSpider ID30657061

More details:

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

3,6-Dibrom-2,7-naphthalindiyl-bis(trifluormethansulfonat) [German] [ACD/IUPAC Name]
3,6-Dibromo-2,7-naphthalenediyl bis(trifluoromethanesulfonate) [ACD/IUPAC Name]
Bis(trifluorométhanesulfonate) de 3,6-dibromo-2,7-naphtalènediyle [French] [ACD/IUPAC Name]
Methanesulfonic acid, 1,1,1-trifluoro-, 3,6-dibromo-2,7-naphthalenediyl ester [ACD/Index Name]
3,6-dibromo-7-(trifluoromethanesulfonyloxy)naphthalen-2-yl trifluoromethanesulfonate
930091-76-2 [RN]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 528.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.3±3.0 kJ/mol
Flash Point: 273.4±30.1 °C
Index of Refraction: 1.565
Molar Refractivity: 90.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 6.03
ACD/LogD (pH 5.5): 6.31
ACD/BCF (pH 5.5): 36986.30
ACD/KOC (pH 5.5): 64771.96
ACD/LogD (pH 7.4): 6.31
ACD/BCF (pH 7.4): 36986.30
ACD/KOC (pH 7.4): 64771.96
Polar Surface Area: 104 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 278.8±3.0 cm3

Click to predict properties on the Chemicalize site


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