ChemSpider 2D Image | 6,7-dibromo-2-methyltetrahydro-β-carboline | C12H12Br2N2

6,7-dibromo-2-methyltetrahydro-β-carboline

  • Molecular FormulaC12H12Br2N2
  • Average mass344.045 Da
  • Monoisotopic mass341.936707 Da
  • ChemSpider ID76117759

More details:

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

1H-Pyrido[3,4-b]indole, 6,7-dibromo-2,3,4,9-tetrahydro-2-methyl- [ACD/Index Name]
6,7-Dibrom-2-methyl-2,3,4,9-tetrahydro-1H-β-carbolin [German] [ACD/IUPAC Name]
6,7-Dibromo-2-methyl-2,3,4,9-tetrahydro-1H-β-carboline [ACD/IUPAC Name]
6,7-Dibromo-2-méthyl-2,3,4,9-tétrahydro-1H-β-carboline [French] [ACD/IUPAC Name]
6,7-dibromo-2-methyltetrahydro-β-carboline

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

Density: 1.8±0.1 g/cm3
Boiling Point: 429.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.5±3.0 kJ/mol
Flash Point: 213.5±27.3 °C
Index of Refraction: 1.701
Molar Refractivity: 74.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 1.19
ACD/KOC (pH 5.5): 6.65
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 51.15
ACD/KOC (pH 7.4): 284.84
Polar Surface Area: 19 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 192.1±3.0 cm3

Click to predict properties on the Chemicalize site


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