ChemSpider 2D Image | 4-Methyl-5-{[2-(1-methyl-2-piperidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-amine | C11H21N5S

4-Methyl-5-{[2-(1-methyl-2-piperidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-amine

  • Molecular FormulaC11H21N5S
  • Average mass255.383 Da
  • Monoisotopic mass255.151764 Da
  • ChemSpider ID33937482

More details:

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

4H-1,2,4-Triazol-3-amine, 4-methyl-5-[[2-(1-methyl-2-piperidinyl)ethyl]thio]- [ACD/Index Name]
4-Methyl-5-{[2-(1-methyl-2-piperidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-amin [German] [ACD/IUPAC Name]
4-Methyl-5-{[2-(1-methyl-2-piperidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-amine [ACD/IUPAC Name]
4-Méthyl-5-{[2-(1-méthyl-2-pipéridinyl)éthyl]sulfanyl}-4H-1,2,4-triazol-3-amine [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 442.5±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.0±3.0 kJ/mol
Flash Point: 221.4±26.5 °C
Index of Refraction: 1.662
Molar Refractivity: 71.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): -1.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 85 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 52.0±7.0 dyne/cm
Molar Volume: 193.3±7.0 cm3

Click to predict properties on the Chemicalize site


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