ChemSpider 2D Image | 5-Isopropyl-1,3-thiazole-2(3H)-thione | C6H9NS2

5-Isopropyl-1,3-thiazole-2(3H)-thione

  • Molecular FormulaC6H9NS2
  • Average mass159.272 Da
  • Monoisotopic mass159.017639 Da
  • ChemSpider ID23979505

More details:

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

2(3H)-Thiazolethione, 5-(1-methylethyl)- [ACD/Index Name]
5-Isopropyl-1,3-thiazol-2(3H)-thion [German] [ACD/IUPAC Name]
5-Isopropyl-1,3-thiazole-2(3H)-thione [ACD/IUPAC Name]
5-Isopropyl-1,3-thiazole-2(3H)-thione [French] [ACD/IUPAC Name]
149432-44-0 [RN]
2(3H)-Thiazolethione, 5-(1-methylethyl)- (9CI)
2(3H)-Thiazolethione,5-(1-methylethyl)-(9CI)
2(3H)-THIAZOLETHIONE,5-(ISOPROPYL)-

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

Density: 1.2±0.1 g/cm3
Boiling Point: 229.5±23.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.6±3.0 kJ/mol
Flash Point: 92.6±22.6 °C
Index of Refraction: 1.629
Molar Refractivity: 46.2±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.36
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.74
ACD/KOC (pH 5.5): 238.70
ACD/LogD (pH 7.4): 1.81
ACD/BCF (pH 7.4): 13.75
ACD/KOC (pH 7.4): 222.75
Polar Surface Area: 69 Å2
Polarizability: 18.3±0.5 10-24cm3
Surface Tension: 52.2±5.0 dyne/cm
Molar Volume: 130.1±5.0 cm3

Click to predict properties on the Chemicalize site


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