ChemSpider 2D Image | N-(5-{[(2E)-2-Hydroxy-4-oxo-2-penten-3-yl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide | C9H11N3O3S2

N-(5-{[(2E)-2-Hydroxy-4-oxo-2-penten-3-yl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide

  • Molecular FormulaC9H11N3O3S2
  • Average mass273.332 Da
  • Monoisotopic mass273.024170 Da
  • ChemSpider ID23026656

  • Double-bond stereo - Double-bond stereo

More details:

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

Acetamide, N-[5-[[(1E)-1-acetyl-2-hydroxy-1-propen-1-yl]thio]-1,3,4-thiadiazol-2-yl]- [ACD/Index Name]
N-(5-{[(2E)-2-Hydroxy-4-oxo-2-penten-3-yl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamid [German] [ACD/IUPAC Name]
N-(5-{[(2E)-2-Hydroxy-4-oxo-2-penten-3-yl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide [ACD/IUPAC Name]
N-(5-{[(2E)-2-Hydroxy-4-oxo-2-pentén-3-yl]sulfanyl}-1,3,4-thiadiazol-2-yl)acétamide [French] [ACD/IUPAC Name]
N-(5-{[(E)-1-acetyl-2-hydroxy-1-propenyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.622
Molar Refractivity: 65.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.17
ACD/LogD (pH 5.5): -0.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.91
ACD/LogD (pH 7.4): -2.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 26.1±0.5 10-24cm3
Surface Tension: 73.1±5.0 dyne/cm
Molar Volume: 186.9±5.0 cm3

Click to predict properties on the Chemicalize site


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