ChemSpider 2D Image | pentabromo-2'-methylthio-bi-1H-indole | C17H9Br5N2S

pentabromo-2'-methylthio-bi-1H-indole

  • Molecular FormulaC17H9Br5N2S
  • Average mass672.852 Da
  • Monoisotopic mass667.640320 Da
  • ChemSpider ID10481015

More details:

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

2,4,4',6,6'-Pentabrom-2'-(methylsulfanyl)-1H,1'H-3,3'-biindol [German] [ACD/IUPAC Name]
2,4,4',6,6'-Pentabromo-2'-(methylsulfanyl)-1H,1'H-3,3'-biindole [ACD/IUPAC Name]
2,4,4',6,6'-Pentabromo-2'-(méthylsulfanyl)-1H,1'H-3,3'-biindole [French] [ACD/IUPAC Name]
3,3'-Bi-1H-indole, 2,4,4',6,6'-pentabromo-2'-(methylthio)- [ACD/Index Name]
pentabromo-2'-methylthio-bi-1H-indole

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

Density: 2.5±0.1 g/cm3
Boiling Point: 729.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 102.6±3.0 kJ/mol
Flash Point: 394.7±32.9 °C
Index of Refraction: 1.896
Molar Refractivity: 125.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 8.67
ACD/LogD (pH 5.5): 8.10
ACD/BCF (pH 5.5): 842538.13
ACD/KOC (pH 5.5): 606884.25
ACD/LogD (pH 7.4): 8.10
ACD/BCF (pH 7.4): 842529.81
ACD/KOC (pH 7.4): 606878.25
Polar Surface Area: 57 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 99.5±5.0 dyne/cm
Molar Volume: 271.0±5.0 cm3

Click to predict properties on the Chemicalize site


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