ChemSpider 2D Image | 2-(1-Methyl-1H-pyrazol-4-yl)-4-[(2-thienylsulfanyl)methyl]-1,3-thiazole | C12H11N3S3

2-(1-Methyl-1H-pyrazol-4-yl)-4-[(2-thienylsulfanyl)methyl]-1,3-thiazole

  • Molecular FormulaC12H11N3S3
  • Average mass293.431 Da
  • Monoisotopic mass293.011505 Da
  • ChemSpider ID30181175

More details:

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

2-(1-Methyl-1H-pyrazol-4-yl)-4-[(2-thienylsulfanyl)methyl]-1,3-thiazol [German] [ACD/IUPAC Name]
2-(1-Methyl-1H-pyrazol-4-yl)-4-[(2-thienylsulfanyl)methyl]-1,3-thiazole [ACD/IUPAC Name]
2-(1-Méthyl-1H-pyrazol-4-yl)-4-[(2-thiénylsulfanyl)méthyl]-1,3-thiazole [French] [ACD/IUPAC Name]
Thiazole, 2-(1-methyl-1H-pyrazol-4-yl)-4-[(2-thienylthio)methyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 497.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 254.9±31.5 °C
Index of Refraction: 1.759
Molar Refractivity: 83.5±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 186.89
ACD/KOC (pH 5.5): 1471.00
ACD/LogD (pH 7.4): 3.29
ACD/BCF (pH 7.4): 186.90
ACD/KOC (pH 7.4): 1471.02
Polar Surface Area: 112 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 61.1±7.0 dyne/cm
Molar Volume: 203.2±7.0 cm3

Click to predict properties on the Chemicalize site


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