ChemSpider 2D Image | 1-Allyl-4-{[(6-bromo-2-naphthyl)oxy]methyl}-1H-1,2,3-triazole | C16H14BrN3O

1-Allyl-4-{[(6-bromo-2-naphthyl)oxy]methyl}-1H-1,2,3-triazole

  • Molecular FormulaC16H14BrN3O
  • Average mass344.206 Da
  • Monoisotopic mass343.032013 Da
  • ChemSpider ID76732145

More details:

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

1-Allyl-4-{[(6-brom-2-naphthyl)oxy]methyl}-1H-1,2,3-triazol [German] [ACD/IUPAC Name]
1-Allyl-4-{[(6-bromo-2-naphthyl)oxy]methyl}-1H-1,2,3-triazole [ACD/IUPAC Name]
1-Allyl-4-{[(6-bromo-2-naphtyl)oxy]méthyl}-1H-1,2,3-triazole [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole, 4-[[(6-bromo-2-naphthalenyl)oxy]methyl]-1-(2-propen-1-yl)- [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: 498.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.7±3.0 kJ/mol
Flash Point: 255.2±31.5 °C
Index of Refraction: 1.639
Molar Refractivity: 87.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 4.35
ACD/BCF (pH 5.5): 1196.28
ACD/KOC (pH 5.5): 5555.35
ACD/LogD (pH 7.4): 4.35
ACD/BCF (pH 7.4): 1196.29
ACD/KOC (pH 7.4): 5555.39
Polar Surface Area: 40 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 47.0±7.0 dyne/cm
Molar Volume: 243.1±7.0 cm3

Click to predict properties on the Chemicalize site


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