ChemSpider 2D Image | Dimethyl 2,3-thiirenedicarboxylate | C6H6O4S

Dimethyl 2,3-thiirenedicarboxylate

  • Molecular FormulaC6H6O4S
  • Average mass174.174 Da
  • Monoisotopic mass173.998672 Da
  • ChemSpider ID28698147

More details:






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

2,3-Thiirènedicarboxylate de diméthyle [French] [ACD/IUPAC Name]
2,3-Thiirenedicarboxylic acid, dimethyl ester [ACD/Index Name]
Dimethyl 2,3-thiirenedicarboxylate [ACD/IUPAC Name]
Dimethyl-2,3-thiirendicarboxylat [German] [ACD/IUPAC Name]
89186-08-3 [RN]
Dimethyl thiirene-2,3-dicarboxylate
THIIRENEDICARBOXYLIC ACID, DIMETHYL ESTER

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 249.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.7±3.0 kJ/mol
Flash Point: 117.0±15.4 °C
Index of Refraction: 1.578
Molar Refractivity: 38.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.80
ACD/LogD (pH 5.5): 0.56
ACD/BCF (pH 5.5): 1.56
ACD/KOC (pH 5.5): 47.92
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.56
ACD/KOC (pH 7.4): 47.92
Polar Surface Area: 78 Å2
Polarizability: 15.4±0.5 10-24cm3
Surface Tension: 58.5±3.0 dyne/cm
Molar Volume: 117.2±3.0 cm3

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