ChemSpider 2D Image | 2-Cyclopropyl-4-[2,5-dimethyl-1-(2-thienylmethyl)-1H-pyrrol-3-yl]-1,3-thiazole | C17H18N2S2

2-Cyclopropyl-4-[2,5-dimethyl-1-(2-thienylmethyl)-1H-pyrrol-3-yl]-1,3-thiazole

  • Molecular FormulaC17H18N2S2
  • Average mass314.468 Da
  • Monoisotopic mass314.091125 Da
  • ChemSpider ID22561574

More details:

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

2-Cyclopropyl-4-[2,5-dimethyl-1-(2-thienylmethyl)-1H-pyrrol-3-yl]-1,3-thiazol [German] [ACD/IUPAC Name]
2-Cyclopropyl-4-[2,5-dimethyl-1-(2-thienylmethyl)-1H-pyrrol-3-yl]-1,3-thiazole [ACD/IUPAC Name]
2-Cyclopropyl-4-[2,5-diméthyl-1-(2-thiénylméthyl)-1H-pyrrol-3-yl]-1,3-thiazole [French] [ACD/IUPAC Name]
Thiazole, 2-cyclopropyl-4-[2,5-dimethyl-1-(2-thienylmethyl)-1H-pyrrol-3-yl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 462.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.6±3.0 kJ/mol
Flash Point: 233.7±28.7 °C
Index of Refraction: 1.721
Molar Refractivity: 93.0±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.33
ACD/LogD (pH 5.5): 4.34
ACD/BCF (pH 5.5): 1167.60
ACD/KOC (pH 5.5): 5450.36
ACD/LogD (pH 7.4): 4.34
ACD/BCF (pH 7.4): 1174.57
ACD/KOC (pH 7.4): 5482.88
Polar Surface Area: 74 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 235.0±7.0 cm3

Click to predict properties on the Chemicalize site


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