6-ethyl-3-thioxo-2H,4H-1,2,4-triazin-5-one

Base Information

• Chemical Name: 6-ethyl-3-thioxo-2H,4H-1,2,4-triazin-5-one
• CAS No.: 452-12-0
• Molecular Formula: C5H7N3OS
• Molecular Weight: 157.196
• DSSTox Substance ID: DTXSID50482695
• Wikidata: Q82319297
• Mol file: 452-12-0.mol

Synonyms:6-ethyl-3-thioxo-2H,4H-1,2,4-triazin-5-one;ST51035625;6-ethyl-3-sulfanylidene-2H-1,2,4-triazin-5-one;SCHEMBL5793071;SCHEMBL17156154;DTXSID50482695;AKOS024385047

Chemical Property of 6-ethyl-3-thioxo-2H,4H-1,2,4-triazin-5-one

Chemical Property:

• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 157.03098303
• Heavy Atom Count: 10
• Complexity: 211

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=NNC(=S)NC1=O