ChemSpider 2D Image | 4-[Hydroxy(4-methylphenyl)methylene]-5-(3-nitrophenyl)-1-{5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}-2,3-pyrrolidinedione | C27H18N4O9S2

4-[Hydroxy(4-methylphenyl)methylene]-5-(3-nitrophenyl)-1-{5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}-2,3-pyrrolidinedione

  • Molecular FormulaC27H18N4O9S2
  • Average mass606.583 Da
  • Monoisotopic mass606.051514 Da
  • ChemSpider ID2505429

More details:

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

2,3-Pyrrolidinedione, 4-[hydroxy(4-methylphenyl)methylene]-5-(3-nitrophenyl)-1-[5-[(4-nitrophenyl)sulfonyl]-2-thiazolyl]- [ACD/Index Name]
4-[Hydroxy(4-methylphenyl)methylen]-5-(3-nitrophenyl)-1-{5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}-2,3-pyrrolidindion [German] [ACD/IUPAC Name]
4-[Hydroxy(4-methylphenyl)methylene]-5-(3-nitrophenyl)-1-{5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}-2,3-pyrrolidinedione [ACD/IUPAC Name]
4-[Hydroxy(4-méthylphényl)méthylène]-5-(3-nitrophényl)-1-{5-[(4-nitrophényl)sulfonyl]-1,3-thiazol-2-yl}-2,3-pyrrolidinedione [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 850.6±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 129.5±3.0 kJ/mol
Flash Point: 468.2±37.1 °C
Index of Refraction: 1.708
Molar Refractivity: 148.5±0.4 cm3
#H bond acceptors: 13
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 3.19
ACD/BCF (pH 5.5): 156.38
ACD/KOC (pH 5.5): 1291.02
ACD/LogD (pH 7.4): 2.93
ACD/BCF (pH 7.4): 86.46
ACD/KOC (pH 7.4): 713.78
Polar Surface Area: 233 Å2
Polarizability: 58.9±0.5 10-24cm3
Surface Tension: 79.9±3.0 dyne/cm
Molar Volume: 380.8±3.0 cm3

Click to predict properties on the Chemicalize site


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