ChemSpider 2D Image | 1-[2-(2-Chlorophenoxy)ethyl]-4-[(5-isopropyl-4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperazine | C19H28ClN5O

1-[2-(2-Chlorophenoxy)ethyl]-4-[(5-isopropyl-4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperazine

  • Molecular FormulaC19H28ClN5O
  • Average mass377.911 Da
  • Monoisotopic mass377.198242 Da
  • ChemSpider ID64936622

More details:

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

1-[2-(2-Chlorophenoxy)ethyl]-4-[(5-isopropyl-4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperazine [ACD/IUPAC Name]
1-[2-(2-Chlorophénoxy)éthyl]-4-[(5-isopropyl-4-méthyl-4H-1,2,4-triazol-3-yl)méthyl]pipérazine [French] [ACD/IUPAC Name]
1-[2-(2-Chlorphenoxy)ethyl]-4-[(5-isopropyl-4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperazin [German] [ACD/IUPAC Name]
Piperazine, 1-[2-(2-chlorophenoxy)ethyl]-4-[[4-methyl-5-(1-methylethyl)-4H-1,2,4-triazol-3-yl]methyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 547.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 285.0±32.9 °C
Index of Refraction: 1.604
Molar Refractivity: 105.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 1.78
ACD/BCF (pH 5.5): 7.89
ACD/KOC (pH 5.5): 82.15
ACD/LogD (pH 7.4): 2.69
ACD/BCF (pH 7.4): 63.64
ACD/KOC (pH 7.4): 662.40
Polar Surface Area: 46 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 43.6±7.0 dyne/cm
Molar Volume: 307.8±7.0 cm3

Click to predict properties on the Chemicalize site


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