ChemSpider 2D Image | 5-Chloro-2-[(1-ethyl-1H-pyrazol-4-yl)amino]-1,3-thiazole-4-carbonitrile | C9H8ClN5S

5-Chloro-2-[(1-ethyl-1H-pyrazol-4-yl)amino]-1,3-thiazole-4-carbonitrile

  • Molecular FormulaC9H8ClN5S
  • Average mass253.711 Da
  • Monoisotopic mass253.018890 Da
  • ChemSpider ID81142796

More details:

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

4-Thiazolecarbonitrile, 5-chloro-2-[(1-ethyl-1H-pyrazol-4-yl)amino]- [ACD/Index Name]
5-Chlor-2-[(1-ethyl-1H-pyrazol-4-yl)amino]-1,3-thiazol-4-carbonitril [German] [ACD/IUPAC Name]
5-Chloro-2-[(1-ethyl-1H-pyrazol-4-yl)amino]-1,3-thiazole-4-carbonitrile [ACD/IUPAC Name]
5-Chloro-2-[(1-éthyl-1H-pyrazol-4-yl)amino]-1,3-thiazole-4-carbonitrile [French] [ACD/IUPAC 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: 461.6±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.3±3.0 kJ/mol
Flash Point: 233.0±30.9 °C
Index of Refraction: 1.734
Molar Refractivity: 66.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.25
ACD/LogD (pH 5.5): 1.52
ACD/BCF (pH 5.5): 8.35
ACD/KOC (pH 5.5): 159.04
ACD/LogD (pH 7.4): 1.52
ACD/BCF (pH 7.4): 8.35
ACD/KOC (pH 7.4): 159.06
Polar Surface Area: 95 Å2
Polarizability: 26.2±0.5 10-24cm3
Surface Tension: 62.1±7.0 dyne/cm
Molar Volume: 165.2±7.0 cm3

Click to predict properties on the Chemicalize site


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