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Search term: VCNCNAPAHSSWCI (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 2,3,6-Tribromophenol | C6H3Br3O

2,3,6-Tribromophenol

  • Molecular FormulaC6H3Br3O
  • Average mass330.799 Da
  • Monoisotopic mass327.773376 Da
  • ChemSpider ID11492110

More details:






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

2,3,6-Tribromophenol [ACD/IUPAC Name]
2,3,6-Tribromophénol [French] [ACD/IUPAC Name]
2,3,6-Tribromphenol [German] [ACD/IUPAC Name]
Phenol, 2,3,6-tribromo- [ACD/Index Name]
28165-57-3 [RN]

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

Density: 2.4±0.1 g/cm3
Boiling Point: 265.5±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.4±3.0 kJ/mol
Flash Point: 114.4±25.9 °C
Index of Refraction: 1.674
Molar Refractivity: 51.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.45
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 647.59
ACD/KOC (pH 5.5): 3271.91
ACD/LogD (pH 7.4): 2.70
ACD/BCF (pH 7.4): 29.61
ACD/KOC (pH 7.4): 149.61
Polar Surface Area: 20 Å2
Polarizability: 20.3±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 136.4±3.0 cm3

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