ChemSpider 2D Image | 4,4'-(3,4-Hexanediyl)bis(3-bromophenol) | C18H20Br2O2

4,4'-(3,4-Hexanediyl)bis(3-bromophenol)

  • Molecular FormulaC18H20Br2O2
  • Average mass428.158 Da
  • Monoisotopic mass425.983002 Da
  • ChemSpider ID23113914

More details:

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

4,4'-(3,4-Hexandiyl)bis(3-bromphenol) [German] [ACD/IUPAC Name]
4,4'-(3,4-Hexanediyl)bis(3-bromophenol) [ACD/IUPAC Name]
4,4'-(3,4-Hexanediyl)bis(3-bromophénol) [French] [ACD/IUPAC Name]
Phenol, 4,4'-(1,2-diethyl-1,2-ethanediyl)bis[3-bromo- [ACD/Index Name]
4,4'-hexane-3,4-diylbis(3-bromophenol)
4-[1-ethyl-2-(4-hydroxy-2-bromophenyl)butyl]-3-bromophenol

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

Density: 1.5±0.1 g/cm3
Boiling Point: 479.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.3±3.0 kJ/mol
Flash Point: 244.0±27.3 °C
Index of Refraction: 1.618
Molar Refractivity: 98.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.28
ACD/LogD (pH 5.5): 6.70
ACD/BCF (pH 5.5): 72358.32
ACD/KOC (pH 5.5): 104699.98
ACD/LogD (pH 7.4): 6.68
ACD/BCF (pH 7.4): 69865.24
ACD/KOC (pH 7.4): 101092.58
Polar Surface Area: 40 Å2
Polarizability: 38.8±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 279.7±3.0 cm3

Click to predict properties on the Chemicalize site


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