ChemSpider 2D Image | [5-(1-Benzofuran-2-ylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid | C14H9NO4S2

[5-(1-Benzofuran-2-ylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid

  • Molecular FormulaC14H9NO4S2
  • Average mass319.356 Da
  • Monoisotopic mass318.997284 Da
  • ChemSpider ID35434555

More details:

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

[5-(1-Benzofuran-2-ylmethylen)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]essigsäure [German] [ACD/IUPAC Name]
[5-(1-Benzofuran-2-ylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid [ACD/IUPAC Name]
3-Thiazolidineacetic acid, 5-(2-benzofuranylmethylene)-4-oxo-2-thioxo- [ACD/Index Name]
Acide [5-(1-benzofuran-2-ylméthylène)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acétique [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: 535.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.5±3.0 kJ/mol
Flash Point: 277.9±32.9 °C
Index of Refraction: 1.789
Molar Refractivity: 83.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.13
ACD/LogD (pH 5.5): -0.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 128 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 94.3±5.0 dyne/cm
Molar Volume: 196.2±5.0 cm3

Click to predict properties on the Chemicalize site


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