Ethyl benzo[c][1,2,5]thiadiazole-4-carboxylate

Base Information

• Chemical Name: Ethyl benzo[c][1,2,5]thiadiazole-4-carboxylate
• CAS No.: 773139-46-1
• Molecular Formula: C9H8N2O2S
• Molecular Weight: 208.24
• DSSTox Substance ID: DTXSID80710812
• Wikidata: Q82646234
• Mol file: 773139-46-1.mol

Synonyms:Ethyl benzo[c][1,2,5]thiadiazole-4-carboxylate;773139-46-1;ethyl 2,1,3-benzothiadiazole-4-carboxylate;DTXSID80710812;Ethylbenzo[c][1,2,5]thiadiazole-4-carboxylate

Chemical Property of Ethyl benzo[c][1,2,5]thiadiazole-4-carboxylate

Chemical Property:

• PKA: -1.00±0.45(Predicted)
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 208.03064868
• Heavy Atom Count: 14
• Complexity: 225

Purity/Quality:

Ethylbenzo[c][1,2,5]thiadiazole-4-carboxylate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C1=CC=CC2=NSN=C21