ChemSpider 2D Image | Dimethyl 4-benzoyl-2,3-thiophenedicarboxylate | C15H12O5S

Dimethyl 4-benzoyl-2,3-thiophenedicarboxylate

  • Molecular FormulaC15H12O5S
  • Average mass304.318 Da
  • Monoisotopic mass304.040558 Da
  • ChemSpider ID30659404

More details:

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

2,3-Thiophenedicarboxylic acid, 4-benzoyl-, dimethyl ester [ACD/Index Name]
4-Benzoyl-2,3-thiophènedicarboxylate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 4-benzoyl-2,3-thiophenedicarboxylate [ACD/IUPAC Name]
Dimethyl-4-benzoyl-2,3-thiophendicarboxylat [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: 418.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 207.1±28.7 °C
Index of Refraction: 1.585
Molar Refractivity: 78.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.89
ACD/LogD (pH 5.5): 2.74
ACD/BCF (pH 5.5): 70.74
ACD/KOC (pH 5.5): 733.84
ACD/LogD (pH 7.4): 2.74
ACD/BCF (pH 7.4): 70.74
ACD/KOC (pH 7.4): 733.84
Polar Surface Area: 98 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 50.2±3.0 dyne/cm
Molar Volume: 232.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement