ChemSpider 2D Image | 3-[(2E)-2-(3-Bromo-4,5-dimethoxybenzylidene)hydrazino]-5-hexyl-5H-[1,2,4]triazino[5,6-b]indole | C24H27BrN6O2

3-[(2E)-2-(3-Bromo-4,5-dimethoxybenzylidene)hydrazino]-5-hexyl-5H-[1,2,4]triazino[5,6-b]indole

  • Molecular FormulaC24H27BrN6O2
  • Average mass511.414 Da
  • Monoisotopic mass510.137878 Da
  • ChemSpider ID29381285

  • Double-bond stereo - Double-bond stereo

More details:

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

3-[(2E)-2-(3-Brom-4,5-dimethoxybenzyliden)hydrazino]-5-hexyl-5H-[1,2,4]triazino[5,6-b]indol [German] [ACD/IUPAC Name]
3-[(2E)-2-(3-Bromo-4,5-dimethoxybenzylidene)hydrazino]-5-hexyl-5H-[1,2,4]triazino[5,6-b]indole [ACD/IUPAC Name]
3-[(2E)-2-(3-Bromo-4,5-diméthoxybenzylidène)hydrazino]-5-hexyl-5H-[1,2,4]triazino[5,6-b]indole [French] [ACD/IUPAC Name]
Benzaldehyde, 3-bromo-4,5-dimethoxy-, 2-(5-hexyl-5H-1,2,4-triazino[5,6-b]indol-3-yl)hydrazone [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: 606.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 320.6±34.3 °C
Index of Refraction: 1.650
Molar Refractivity: 132.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.71
ACD/LogD (pH 5.5): 6.38
ACD/BCF (pH 5.5): 38492.09
ACD/KOC (pH 5.5): 60445.50
ACD/LogD (pH 7.4): 6.35
ACD/BCF (pH 7.4): 35684.59
ACD/KOC (pH 7.4): 56036.78
Polar Surface Area: 86 Å2
Polarizability: 52.3±0.5 10-24cm3
Surface Tension: 48.4±7.0 dyne/cm
Molar Volume: 361.8±7.0 cm3

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