ChemSpider 2D Image | 4-{4-[2-(4,5,6,7-Tetrabromo-2H-benzotriazol-2-yl)ethyl]-1H-1,2,3-triazol-1-yl}-1-butanamine | C14H15Br4N7

4-{4-[2-(4,5,6,7-Tetrabromo-2H-benzotriazol-2-yl)ethyl]-1H-1,2,3-triazol-1-yl}-1-butanamine

  • Molecular FormulaC14H15Br4N7
  • Average mass600.932 Da
  • Monoisotopic mass596.812195 Da
  • ChemSpider ID35033937

More details:

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

1H-1,2,3-Triazole-1-butanamine, 4-[2-(4,5,6,7-tetrabromo-2H-1,2,3-benzotriazol-2-yl)ethyl]- [ACD/Index Name]
4-[4-[2-[4,5,6,7-Tetrakis(Bromanyl)benzotriazol-2-Yl]ethyl]-1,2,3-Triazol-1-Yl]butan-1-Amine
4-{4-[2-(4,5,6,7-Tetrabrom-2H-benzotriazol-2-yl)ethyl]-1H-1,2,3-triazol-1-yl}-1-butanamin [German] [ACD/IUPAC Name]
4-{4-[2-(4,5,6,7-Tetrabromo-2H-benzotriazol-2-yl)ethyl]-1H-1,2,3-triazol-1-yl}-1-butanamine [ACD/IUPAC Name]
4-{4-[2-(4,5,6,7-Tétrabromo-2H-benzotriazol-2-yl)éthyl]-1H-1,2,3-triazol-1-yl}-1-butanamine [French] [ACD/IUPAC Name]
JRJ

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

Density: 2.3±0.1 g/cm3
Boiling Point: 670.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.5±3.0 kJ/mol
Flash Point: 359.1±34.3 °C
Index of Refraction: 1.806
Molar Refractivity: 111.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.78
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.69
ACD/LogD (pH 7.4): 1.56
ACD/BCF (pH 7.4): 2.09
ACD/KOC (pH 7.4): 10.53
Polar Surface Area: 87 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 72.8±7.0 dyne/cm
Molar Volume: 259.9±7.0 cm3

Click to predict properties on the Chemicalize site


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