ChemSpider 2D Image | (2E)-3-(1,2,4-Thiadiazol-5-ylsulfanyl)acrylic acid | C5H4N2O2S2

(2E)-3-(1,2,4-Thiadiazol-5-ylsulfanyl)acrylic acid

  • Molecular FormulaC5H4N2O2S2
  • Average mass188.227 Da
  • Monoisotopic mass187.971420 Da
  • ChemSpider ID72092755

More details:

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

(2E)-3-(1,2,4-Thiadiazol-5-ylsulfanyl)acrylic acid [ACD/IUPAC Name]
(2E)-3-(1,2,4-Thiadiazol-5-ylsulfanyl)acrylsäure [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-(1,2,4-thiadiazol-5-ylthio)-, (2E)- [ACD/Index Name]
Acide (2E)-3-(1,2,4-thiadiazol-5-ylsulfanyl)acrylique [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: 390.3±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.5±3.0 kJ/mol
Flash Point: 189.9±28.4 °C
Index of Refraction: 1.673
Molar Refractivity: 44.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.44
ACD/LogD (pH 5.5): -1.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 117 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 90.8±5.0 dyne/cm
Molar Volume: 117.2±5.0 cm3

Click to predict properties on the Chemicalize site


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