ChemSpider 2D Image | 2,2'-[(1,5-Dioxo-1,5-pentanediyl)bis(oxy)]bis(3,5-dibromobenzoic acid) | C19H12Br4O8

2,2'-[(1,5-Dioxo-1,5-pentanediyl)bis(oxy)]bis(3,5-dibromobenzoic acid)

  • Molecular FormulaC19H12Br4O8
  • Average mass687.910 Da
  • Monoisotopic mass683.726563 Da
  • ChemSpider ID180991

More details:






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

2,2'-[(1,5-Dioxo-1,5-pentandiyl)bis(oxy)]bis(3,5-dibrombenzoesäure) [German] [ACD/IUPAC Name]
2,2'-[(1,5-Dioxo-1,5-pentanediyl)bis(oxy)]bis(3,5-dibromobenzoic acid) [ACD/IUPAC Name]
Acide 2,2'-[(1,5-dioxo-1,5-pentanediyl)bis(oxy)]bis(3,5-dibromobenzoïque) [French] [ACD/IUPAC Name]
Pentanedioic acid, bis(2,4-dibromo-6-carboxyphenyl) ester [ACD/Index Name]
75848-75-8 [RN]
Bis(2,4-dibromo-6-carboxyphenyl) pentanedioate
bis(3,5-dibromosalicyl)glutarate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.1±0.1 g/cm3
Boiling Point: 735.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 112.7±3.0 kJ/mol
Flash Point: 398.8±32.9 °C
Index of Refraction: 1.659
Molar Refractivity: 122.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.08
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 2.04
ACD/KOC (pH 5.5): 3.85
ACD/LogD (pH 7.4): 2.01
ACD/BCF (pH 7.4): 2.01
ACD/KOC (pH 7.4): 3.79
Polar Surface Area: 127 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 67.5±3.0 dyne/cm
Molar Volume: 331.9±3.0 cm3

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