ChemSpider 2D Image | 13-(4-Bromobenzyl)-5,6,12b,13-tetrahydro-4bH-indolo[3,2-c]acridine | C26H21BrN2

13-(4-Bromobenzyl)-5,6,12b,13-tetrahydro-4bH-indolo[3,2-c]acridine

  • Molecular FormulaC26H21BrN2
  • Average mass441.362 Da
  • Monoisotopic mass440.088806 Da
  • ChemSpider ID111707496

More details:

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

13-(4-Brombenzyl)-5,6,12b,13-tetrahydro-4bH-indolo[3,2-c]acridin [German] [ACD/IUPAC Name]
13-(4-Bromobenzyl)-5,6,12b,13-tetrahydro-4bH-indolo[3,2-c]acridine [ACD/IUPAC Name]
13-(4-Bromobenzyl)-5,6,12b,13-tétrahydro-4bH-indolo[3,2-c]acridine [French] [ACD/IUPAC Name]
5H-Acrindoline, 13-[(4-bromophenyl)methyl]-4b,6,12b,13-tetrahydro- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 585.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.5±3.0 kJ/mol
Flash Point: 308.0±30.1 °C
Index of Refraction: 1.707
Molar Refractivity: 122.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.85
ACD/LogD (pH 5.5): 6.86
ACD/BCF (pH 5.5): 93578.41
ACD/KOC (pH 5.5): 122377.97
ACD/LogD (pH 7.4): 6.90
ACD/BCF (pH 7.4): 103201.20
ACD/KOC (pH 7.4): 134962.25
Polar Surface Area: 16 Å2
Polarizability: 48.4±0.5 10-24cm3
Surface Tension: 57.6±3.0 dyne/cm
Molar Volume: 313.2±3.0 cm3

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