ChemSpider 2D Image | 3-(4-Nitrobenzyl)-2-(4-nitrophenyl)-1,3-thiazolidin-4-one | C16H13N3O5S

3-(4-Nitrobenzyl)-2-(4-nitrophenyl)-1,3-thiazolidin-4-one

  • Molecular FormulaC16H13N3O5S
  • Average mass359.357 Da
  • Monoisotopic mass359.057587 Da
  • ChemSpider ID21133288

More details:

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

3-(4-Nitrobenzyl)-2-(4-nitrophenyl)-1,3-thiazolidin-4-on [German] [ACD/IUPAC Name]
3-(4-Nitrobenzyl)-2-(4-nitrophenyl)-1,3-thiazolidin-4-one [ACD/IUPAC Name]
3-(4-Nitrobenzyl)-2-(4-nitrophényl)-1,3-thiazolidin-4-one [French] [ACD/IUPAC Name]
4-Thiazolidinone, 2-(4-nitrophenyl)-3-[(4-nitrophenyl)methyl]- [ACD/Index Name]
2-(4-Nitrophenyl)-3-[(4-nitrophenyl)methyl]-1,3-thiazolidin-4-one
918538-34-8 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 648.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.6±3.0 kJ/mol
Flash Point: 346.1±31.5 °C
Index of Refraction: 1.689
Molar Refractivity: 92.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 3.08
ACD/BCF (pH 5.5): 128.55
ACD/KOC (pH 5.5): 1125.36
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 128.55
ACD/KOC (pH 7.4): 1125.36
Polar Surface Area: 137 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 71.8±3.0 dyne/cm
Molar Volume: 241.9±3.0 cm3

Click to predict properties on the Chemicalize site


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