ChemSpider 2D Image | 2,3-Dihydro-3,4-thiophenedicarboxylic acid | C6H6O4S

2,3-Dihydro-3,4-thiophenedicarboxylic acid

  • Molecular FormulaC6H6O4S
  • Average mass174.174 Da
  • Monoisotopic mass173.998672 Da
  • ChemSpider ID21410014

More details:






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

2,3-Dihydro-3,4-thiophendicarbonsäure [German] [ACD/IUPAC Name]
2,3-Dihydro-3,4-thiophenedicarboxylic acid [ACD/IUPAC Name]
20687-62-1 [RN]
3,4-Thiophenedicarboxylic acid, 2,3-dihydro- [ACD/Index Name]
Acide 2,3-dihydro-3,4-thiophènedicarboxylique [French] [ACD/IUPAC Name]
MFCD20642206

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

Density: 1.7±0.1 g/cm3
Boiling Point: 433.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 75.6±6.0 kJ/mol
Flash Point: 216.0±28.7 °C
Index of Refraction: 1.661
Molar Refractivity: 38.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.34
ACD/LogD (pH 5.5): -2.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 100 Å2
Polarizability: 15.2±0.5 10-24cm3
Surface Tension: 88.9±3.0 dyne/cm
Molar Volume: 104.0±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement