ChemSpider 2D Image | Tetrabromobisphenol A | C15H12Br4O2

Tetrabromobisphenol A

  • Molecular FormulaC15H12Br4O2
  • Average mass543.871 Da
  • Monoisotopic mass539.757080 Da
  • ChemSpider ID6366

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Featured data source



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

2,2',6,6'-tetrabromo-4,4'-propane-2,2-diyldiphenol
2,6-dibromo-4-[1-(3,5-dibromo-4-hydroxyphenyl)-1-methylethyl]phenol
3,3',5,5'-tetrabromo bisphenol a
3,3',5,5'-Tetrabromobisphenol A
4,4'-(2,2-Propandiyl)bis(2,6-dibromphenol) [German] [ACD/IUPAC Name]
4,4'-(2,2-Propanediyl)bis(2,6-dibromophenol) [ACD/IUPAC Name]
4,4'-(2,2-Propanediyl)bis(2,6-dibromophénol) [French] [ACD/IUPAC Name]
4,4'-Propan-2,2-diylbis(2,6-dibromphenol)
4,4'-propane-2,2-diylbis(2,6-dibromophenol)
79-94-7 [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

03763_FLUKA [DBID]
330396_ALDRICH [DBID]
BA 59 [DBID]
bmse000567 [DBID]
c0763 [DBID]
C13620 [DBID]
CCRIS 5836 [DBID]
CCRIS 6274 [DBID]
CHEBI:33217 [DBID]
FG 2000 [DBID]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.1±0.1 g/cm3
Boiling Point: 417.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.7±3.0 kJ/mol
Flash Point: 206.6±27.3 °C
Index of Refraction: 1.672
Molar Refractivity: 98.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 7.29
ACD/LogD (pH 5.5): 6.80
ACD/BCF (pH 5.5): 86729.27
ACD/KOC (pH 5.5): 119177.63
ACD/LogD (pH 7.4): 6.77
ACD/BCF (pH 7.4): 80298.85
ACD/KOC (pH 7.4): 110341.38
Polar Surface Area: 40 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 55.6±3.0 dyne/cm
Molar Volume: 264.3±3.0 cm3

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