ChemSpider 2D Image | Dimethyl 2,2'-[1,2-phenylenebis(carbonylimino)]bis[4-(4-methylphenyl)-3-thiophenecarboxylate] | C34H28N2O6S2

Dimethyl 2,2'-[1,2-phenylenebis(carbonylimino)]bis[4-(4-methylphenyl)-3-thiophenecarboxylate]

  • Molecular FormulaC34H28N2O6S2
  • Average mass624.726 Da
  • Monoisotopic mass624.138855 Da
  • ChemSpider ID3405053

More details:

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

2,2'-[1,2-Phénylènebis(carbonylimino)]bis[4-(4-méthylphényl)-3-thiophènecarboxylate] de diméthyle [French] [ACD/IUPAC Name]
3-Thiophenecarboxylic acid, 2,2'-[1,2-phenylenebis(carbonylimino)]bis[4-(4-methylphenyl)-, dimethyl ester [ACD/Index Name]
Dimethyl 2,2'-[1,2-phenylenebis(carbonylimino)]bis[4-(4-methylphenyl)-3-thiophenecarboxylate] [ACD/IUPAC Name]
Dimethyl-2,2'-[1,2-phenylenbis(carbonylimino)]bis[4-(4-methylphenyl)-3-thiophencarboxylat] [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 674.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.0±3.0 kJ/mol
Flash Point: 361.6±31.5 °C
Index of Refraction: 1.674
Molar Refractivity: 174.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 9.13
ACD/LogD (pH 5.5): 7.53
ACD/BCF (pH 5.5): 311969.75
ACD/KOC (pH 5.5): 298029.59
ACD/LogD (pH 7.4): 7.53
ACD/BCF (pH 7.4): 311950.56
ACD/KOC (pH 7.4): 298011.25
Polar Surface Area: 167 Å2
Polarizability: 69.2±0.5 10-24cm3
Surface Tension: 58.2±3.0 dyne/cm
Molar Volume: 465.0±3.0 cm3

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