ChemSpider 2D Image | 1-(4-Isopropyl-2-thioxo-1,3-thiazolidin-3-yl)-1-butanone | C10H17NOS2

1-(4-Isopropyl-2-thioxo-1,3-thiazolidin-3-yl)-1-butanone

  • Molecular FormulaC10H17NOS2
  • Average mass231.378 Da
  • Monoisotopic mass231.075150 Da
  • ChemSpider ID28677776

More details:

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

1-(4-Isopropyl-2-thioxo-1,3-thiazolidin-3-yl)-1-butanon [German] [ACD/IUPAC Name]
1-(4-Isopropyl-2-thioxo-1,3-thiazolidin-3-yl)-1-butanone [ACD/IUPAC Name]
1-(4-Isopropyl-2-thioxo-1,3-thiazolidin-3-yl)-1-butanone [French] [ACD/IUPAC Name]
1-Butanone, 1-[4-(1-methylethyl)-2-thioxo-3-thiazolidinyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 312.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.4±3.0 kJ/mol
Flash Point: 142.9±23.2 °C
Index of Refraction: 1.569
Molar Refractivity: 65.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.77
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.61
ACD/KOC (pH 5.5): 237.26
ACD/LogD (pH 7.4): 1.84
ACD/BCF (pH 7.4): 14.61
ACD/KOC (pH 7.4): 237.26
Polar Surface Area: 78 Å2
Polarizability: 25.9±0.5 10-24cm3
Surface Tension: 48.9±5.0 dyne/cm
Molar Volume: 199.5±5.0 cm3

Click to predict properties on the Chemicalize site


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