ChemSpider 2D Image | 5,5',7,7'-Tetrabromo-3-hydroxy-1H,3'H-2,2'-biindol-3'-one | C16H6Br4N2O2

5,5',7,7'-Tetrabromo-3-hydroxy-1H,3'H-2,2'-biindol-3'-one

  • Molecular FormulaC16H6Br4N2O2
  • Average mass577.847 Da
  • Monoisotopic mass573.716248 Da
  • ChemSpider ID95593628

More details:

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

3H-Indol-3-one, 5,7-dibromo-2-(5,7-dibromo-3-hydroxy-1H-indol-2-yl)- [ACD/Index Name]
5,5',7,7'-Tetrabrom-3-hydroxy-1H,3'H-2,2'-biindol-3'-on [German] [ACD/IUPAC Name]
5,5',7,7'-Tetrabromo-3-hydroxy-1H,3'H-2,2'-biindol-3'-one [ACD/IUPAC Name]
5,5',7,7'-Tétrabromo-3-hydroxy-1H,3'H-2,2'-biindol-3'-one [French] [ACD/IUPAC Name]
2475-31-2 [RN]
Ciba Blue 2B
Tetrabromoindigo
Vat Blue 4B

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

Density: 2.5±0.1 g/cm3
Boiling Point: 714.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.2±3.0 kJ/mol
Flash Point: 386.1±35.7 °C
Index of Refraction: 1.864
Molar Refractivity: 104.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 4.95
ACD/LogD (pH 5.5): 5.86
ACD/BCF (pH 5.5): 16606.01
ACD/KOC (pH 5.5): 36424.07
ACD/LogD (pH 7.4): 5.63
ACD/BCF (pH 7.4): 9925.04
ACD/KOC (pH 7.4): 21769.85
Polar Surface Area: 65 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 75.1±7.0 dyne/cm
Molar Volume: 230.3±7.0 cm3

Click to predict properties on the Chemicalize site


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