ChemSpider 2D Image | 3-{4-[2-(4-Bromophenoxy)ethyl]-1-piperazinyl}-1H-1,2,4-triazol-5-amine | C14H19BrN6O

3-{4-[2-(4-Bromophenoxy)ethyl]-1-piperazinyl}-1H-1,2,4-triazol-5-amine

  • Molecular FormulaC14H19BrN6O
  • Average mass367.244 Da
  • Monoisotopic mass366.080353 Da
  • ChemSpider ID14922555

More details:

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

3-{4-[2-(4-Bromophenoxy)ethyl]-1-piperazinyl}-1H-1,2,4-triazol-5-amine [ACD/IUPAC Name]
3-{4-[2-(4-Bromophénoxy)éthyl]-1-pipérazinyl}-1H-1,2,4-triazol-5-amine [French] [ACD/IUPAC Name]
3-{4-[2-(4-Bromphenoxy)ethyl]-1-piperazinyl}-1H-1,2,4-triazol-5-amin [German] [ACD/IUPAC Name]
4H-1,2,4-Triazol-3-amine, 5-[4-[2-(4-bromophenoxy)ethyl]-1-piperazinyl]- [ACD/Index Name]
5-{4-[2-(4-Bromophenoxy)ethyl]piperazin-1-Yl}-4h-1,2,4-Triazol-3-Amine
3RM

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

Density: 1.5±0.1 g/cm3
Boiling Point: 577.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 303.0±32.9 °C
Index of Refraction: 1.649
Molar Refractivity: 88.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.30
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.87
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 5.96
ACD/KOC (pH 7.4): 120.30
Polar Surface Area: 83 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 67.2±3.0 dyne/cm
Molar Volume: 242.0±3.0 cm3

Click to predict properties on the Chemicalize site


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