2-[(5Z)-4-oxo-5-(pyridin-3-ylmethylene)-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid

Base Information

• Chemical Name: 2-[(5Z)-4-oxo-5-(pyridin-3-ylmethylene)-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
• CAS No.: 5860-92-4
• Molecular Formula: C12H10N2O3S2
• Molecular Weight: 294.3494
• DSSTox Substance ID: DTXSID50416672

Synonyms:5860-92-4;2-[(5Z)-4-oxo-5-(pyridin-3-ylmethylene)-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid;AC1NSO8S;DTXSID50416672;SMSF0008227;STK994106;AKOS001613907;AKOS016048656;CB00359;AB00099551-01;2-[(5Z)-4-oxo-5-(pyridin-3-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid

Chemical Property of 2-[(5Z)-4-oxo-5-(pyridin-3-ylmethylene)-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid

Chemical Property:

• Vapor Pressure: 7.94E-11mmHg at 25°C
• Boiling Point: 500.2°C at 760 mmHg
• Flash Point: 256.3°C
• Density: 1.54g/cm³
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 294.01328453
• Heavy Atom Count: 19
• Complexity: 450

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(=O)O)N1C(=O)C(=CC2=CN=CC=C2)SC1=S
• Isomeric SMILES: CC(C(=O)O)N1C(=O)/C(=C/C2=CN=CC=C2)/SC1=S

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