ChemSpider 2D Image | (5E)-3-Methyl-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one | C11H8N2O3S2

(5E)-3-Methyl-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one

  • Molecular FormulaC11H8N2O3S2
  • Average mass280.323 Da
  • Monoisotopic mass279.997620 Da
  • ChemSpider ID22844305

  • Double-bond stereo - Double-bond stereo

More details:

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

(5E)-3-Methyl-5-(3-nitrobenzyliden)-2-thioxo-1,3-thiazolidin-4-on [German] [ACD/IUPAC Name]
(5E)-3-Methyl-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one [ACD/IUPAC Name]
(5E)-3-Méthyl-5-(3-nitrobenzylidène)-2-thioxo-1,3-thiazolidin-4-one [French] [ACD/IUPAC Name]
4-Thiazolidinone, 3-methyl-5-[(3-nitrophenyl)methylene]-2-thioxo-, (5E)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 433.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 216.2±31.5 °C
Index of Refraction: 1.735
Molar Refractivity: 72.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.77
ACD/LogD (pH 5.5): 1.61
ACD/BCF (pH 5.5): 9.79
ACD/KOC (pH 5.5): 178.18
ACD/LogD (pH 7.4): 1.61
ACD/BCF (pH 7.4): 9.79
ACD/KOC (pH 7.4): 178.18
Polar Surface Area: 124 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 82.4±5.0 dyne/cm
Molar Volume: 181.2±5.0 cm3

Click to predict properties on the Chemicalize site


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