ChemSpider 2D Image | 4-(3-Thienyl)-1,3-thiazole | C7H5NS2

4-(3-Thienyl)-1,3-thiazole

  • Molecular FormulaC7H5NS2
  • Average mass167.251 Da
  • Monoisotopic mass166.986343 Da
  • ChemSpider ID61526011

More details:






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

4-(3-Thienyl)-1,3-thiazol [German] [ACD/IUPAC Name]
4-(3-Thienyl)-1,3-thiazole [ACD/IUPAC Name]
4-(3-Thiényl)-1,3-thiazole [French] [ACD/IUPAC Name]
Thiazole, 4-(3-thienyl)- [ACD/Index Name]
1849288-94-3 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 260.8±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.8±3.0 kJ/mol
Flash Point: 112.1±10.8 °C
Index of Refraction: 1.640
Molar Refractivity: 45.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 63.09
ACD/KOC (pH 5.5): 675.98
ACD/LogD (pH 7.4): 2.67
ACD/BCF (pH 7.4): 63.12
ACD/KOC (pH 7.4): 676.38
Polar Surface Area: 69 Å2
Polarizability: 18.1±0.5 10-24cm3
Surface Tension: 52.2±3.0 dyne/cm
Molar Volume: 126.9±3.0 cm3

Click to predict properties on the Chemicalize site






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