ChemSpider 2D Image | 3-{[(1-Ethyl-1H-1,2,4-triazol-5-yl)methyl]sulfanyl}-1H-1,2,4-triazol-5-amine | C7H11N7S

3-{[(1-Ethyl-1H-1,2,4-triazol-5-yl)methyl]sulfanyl}-1H-1,2,4-triazol-5-amine

  • Molecular FormulaC7H11N7S
  • Average mass225.274 Da
  • Monoisotopic mass225.079666 Da
  • ChemSpider ID48942093

More details:

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

1H-1,2,4-Triazol-5-amine, 3-[[(1-ethyl-1H-1,2,4-triazol-5-yl)methyl]thio]- [ACD/Index Name]
3-{[(1-Ethyl-1H-1,2,4-triazol-5-yl)methyl]sulfanyl}-1H-1,2,4-triazol-5-amin [German] [ACD/IUPAC Name]
3-{[(1-Ethyl-1H-1,2,4-triazol-5-yl)methyl]sulfanyl}-1H-1,2,4-triazol-5-amine [ACD/IUPAC Name]
3-{[(1-Éthyl-1H-1,2,4-triazol-5-yl)méthyl]sulfanyl}-1H-1,2,4-triazol-5-amine [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 551.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.2±3.0 kJ/mol
Flash Point: 287.5±32.9 °C
Index of Refraction: 1.831
Molar Refractivity: 58.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.12
ACD/LogD (pH 5.5): 0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 26.06
ACD/LogD (pH 7.4): 0.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.16
Polar Surface Area: 124 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 79.3±7.0 dyne/cm
Molar Volume: 133.1±7.0 cm3

Click to predict properties on the Chemicalize site


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