ChemSpider 2D Image | (5E)-5-(2-Hydroxy-5-nitrobenzylidene)-3-[(4-nitrophenyl)amino]-2-thioxo-1,3-thiazolidin-4-one | C16H10N4O6S2

(5E)-5-(2-Hydroxy-5-nitrobenzylidene)-3-[(4-nitrophenyl)amino]-2-thioxo-1,3-thiazolidin-4-one

  • Molecular FormulaC16H10N4O6S2
  • Average mass418.404 Da
  • Monoisotopic mass418.004181 Da
  • ChemSpider ID58542015

  • Double-bond stereo - Double-bond stereo

More details:

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

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

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

Density: 1.7±0.1 g/cm3
Boiling Point: 649.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 346.4±34.3 °C
Index of Refraction: 1.816
Molar Refractivity: 104.0±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 76.85
ACD/KOC (pH 5.5): 593.24
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 1.70
ACD/KOC (pH 7.4): 13.09
Polar Surface Area: 202 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 112.1±5.0 dyne/cm
Molar Volume: 239.8±5.0 cm3

Click to predict properties on the Chemicalize site


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