ChemSpider 2D Image | (4S)-4-Isopropyl-2-thioxo-1,3-thiazolidin-5-one | C6H9NOS2

(4S)-4-Isopropyl-2-thioxo-1,3-thiazolidin-5-one

  • Molecular FormulaC6H9NOS2
  • Average mass175.272 Da
  • Monoisotopic mass175.012558 Da
  • ChemSpider ID24211688

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-4-Isopropyl-2-thioxo-1,3-thiazolidin-5-on [German] [ACD/IUPAC Name]
(4S)-4-Isopropyl-2-thioxo-1,3-thiazolidin-5-one [ACD/IUPAC Name]
(4S)-4-Isopropyl-2-thioxo-1,3-thiazolidin-5-one [French] [ACD/IUPAC Name]
5-Thiazolidinone, 4-(1-methylethyl)-2-thioxo-, (4S)- [ACD/Index Name]
(S)-4-isopropyl-2-thioxothiazolidin-5-one
5-Thiazolidinone, 4-(1-methylethyl)-2-thioxo-, (S)- (9CI)
76532-56-4 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 243.0±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.0±3.0 kJ/mol
Flash Point: 100.8±22.6 °C
Index of Refraction: 1.608
Molar Refractivity: 46.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.43
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 4.08
ACD/KOC (pH 5.5): 95.27
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 3.84
ACD/KOC (pH 7.4): 89.58
Polar Surface Area: 86 Å2
Polarizability: 18.5±0.5 10-24cm3
Surface Tension: 56.1±5.0 dyne/cm
Molar Volume: 134.8±5.0 cm3

Click to predict properties on the Chemicalize site


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