ChemSpider 2D Image | 1-{[2-(1-Ethoxyethyl)-1,3-thiazol-4-yl]methyl}-3-nitro-1H-1,2,4-triazole | C10H13N5O3S

1-{[2-(1-Ethoxyethyl)-1,3-thiazol-4-yl]methyl}-3-nitro-1H-1,2,4-triazole

  • Molecular FormulaC10H13N5O3S
  • Average mass283.307 Da
  • Monoisotopic mass283.073914 Da
  • ChemSpider ID30470934

More details:

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

1-{[2-(1-Ethoxyethyl)-1,3-thiazol-4-yl]methyl}-3-nitro-1H-1,2,4-triazol [German] [ACD/IUPAC Name]
1-{[2-(1-Ethoxyethyl)-1,3-thiazol-4-yl]methyl}-3-nitro-1H-1,2,4-triazole [ACD/IUPAC Name]
1-{[2-(1-Éthoxyéthyl)-1,3-thiazol-4-yl]méthyl}-3-nitro-1H-1,2,4-triazole [French] [ACD/IUPAC Name]
Thiazole, 2-(1-ethoxyethyl)-4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 479.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.3±3.0 kJ/mol
Flash Point: 243.6±31.5 °C
Index of Refraction: 1.690
Molar Refractivity: 71.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.66
ACD/LogD (pH 5.5): 0.98
ACD/BCF (pH 5.5): 3.27
ACD/KOC (pH 5.5): 81.19
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 3.27
ACD/KOC (pH 7.4): 81.19
Polar Surface Area: 127 Å2
Polarizability: 28.2±0.5 10-24cm3
Surface Tension: 62.4±7.0 dyne/cm
Molar Volume: 186.2±7.0 cm3

Click to predict properties on the Chemicalize site


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