ChemSpider 2D Image | 3-(1,3-Thiazol-2-yl)-4H-1,2,4-triazole | C5H4N4S

3-(1,3-Thiazol-2-yl)-4H-1,2,4-triazole

  • Molecular FormulaC5H4N4S
  • Average mass152.177 Da
  • Monoisotopic mass152.015671 Da
  • ChemSpider ID27029287

More details:

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

3-(1,3-Thiazol-2-yl)-4H-1,2,4-triazol [German] [ACD/IUPAC Name]
3-(1,3-Thiazol-2-yl)-4H-1,2,4-triazole [ACD/IUPAC Name]
3-(1,3-Thiazol-2-yl)-4H-1,2,4-triazole [French] [ACD/IUPAC Name]
1340241-97-5 [RN]
3-(1,3-Thiazol-2-yl)-1H-1,2,4-triazol [German] [ACD/IUPAC Name]
3-(1,3-Thiazol-2-yl)-1H-1,2,4-triazole [ACD/IUPAC Name]
3-(1,3-Thiazol-2-yl)-1H-1,2,4-triazole [French] [ACD/IUPAC Name]
MFCD17255998
Thiazole, 2-(4H-1,2,4-triazol-3-yl)- [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: 391.5±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.1±3.0 kJ/mol
Flash Point: 200.7±13.5 °C
Index of Refraction: 1.665
Molar Refractivity: 37.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.63
ACD/LogD (pH 5.5): 0.63
ACD/BCF (pH 5.5): 1.76
ACD/KOC (pH 5.5): 52.24
ACD/LogD (pH 7.4): 0.61
ACD/BCF (pH 7.4): 1.67
ACD/KOC (pH 7.4): 49.61
Polar Surface Area: 83 Å2
Polarizability: 15.0±0.5 10-24cm3
Surface Tension: 80.2±3.0 dyne/cm
Molar Volume: 102.2±3.0 cm3

Click to predict properties on the Chemicalize site


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