ChemSpider 2D Image | (5E)-5-[(2E)-3-(5-Nitro-2-furyl)-2-propen-1-ylidene]-3-[(2-nitrophenyl)amino]-2-thioxo-1,3-thiazolidin-4-one | C16H10N4O6S2

(5E)-5-[(2E)-3-(5-Nitro-2-furyl)-2-propen-1-ylidene]-3-[(2-nitrophenyl)amino]-2-thioxo-1,3-thiazolidin-4-one

  • Molecular FormulaC16H10N4O6S2
  • Average mass418.404 Da
  • Monoisotopic mass418.004181 Da
  • ChemSpider ID58542175

  • Double-bond stereo - Double-bond stereo

More details:

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

(5E)-5-[(2E)-3-(5-Nitro-2-furyl)-2-propen-1-yliden]-3-[(2-nitrophenyl)amino]-2-thioxo-1,3-thiazolidin-4-on [German] [ACD/IUPAC Name]
(5E)-5-[(2E)-3-(5-Nitro-2-furyl)-2-propen-1-ylidene]-3-[(2-nitrophenyl)amino]-2-thioxo-1,3-thiazolidin-4-one [ACD/IUPAC Name]
(5E)-5-[(2E)-3-(5-Nitro-2-furyl)-2-propén-1-ylidène]-3-[(2-nitrophényl)amino]-2-thioxo-1,3-thiazolidin-4-one [French] [ACD/IUPAC Name]
4-Thiazolidinone, 5-[(2E)-3-(5-nitro-2-furanyl)-2-propen-1-ylidene]-3-[(2-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: 596.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.9±3.0 kJ/mol
Flash Point: 314.5±32.9 °C
Index of Refraction: 1.768
Molar Refractivity: 104.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.52
ACD/LogD (pH 5.5): 2.82
ACD/BCF (pH 5.5): 82.06
ACD/KOC (pH 5.5): 816.13
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 82.06
ACD/KOC (pH 7.4): 816.13
Polar Surface Area: 195 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 97.1±5.0 dyne/cm
Molar Volume: 251.1±5.0 cm3

Click to predict properties on the Chemicalize site


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