ChemSpider 2D Image | 1-Methyl-4-{3-[(1-methyl-1H-1,2,4-triazol-5-yl)sulfanyl]propyl}piperazine | C11H21N5S

1-Methyl-4-{3-[(1-methyl-1H-1,2,4-triazol-5-yl)sulfanyl]propyl}piperazine

  • Molecular FormulaC11H21N5S
  • Average mass255.383 Da
  • Monoisotopic mass255.151764 Da
  • ChemSpider ID35182174

More details:

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

1-Methyl-4-{3-[(1-methyl-1H-1,2,4-triazol-5-yl)sulfanyl]propyl}piperazin [German] [ACD/IUPAC Name]
1-Methyl-4-{3-[(1-methyl-1H-1,2,4-triazol-5-yl)sulfanyl]propyl}piperazine [ACD/IUPAC Name]
1-Méthyl-4-{3-[(1-méthyl-1H-1,2,4-triazol-5-yl)sulfanyl]propyl}pipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-methyl-4-[3-[(1-methyl-1H-1,2,4-triazol-5-yl)thio]propyl]- [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: 422.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.7±3.0 kJ/mol
Flash Point: 209.5±31.5 °C
Index of Refraction: 1.628
Molar Refractivity: 73.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.12
ACD/LogD (pH 5.5): -1.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.40
Polar Surface Area: 62 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 48.1±7.0 dyne/cm
Molar Volume: 207.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement