S-tert-Butyl 3-oxohept-6-enethioate

Base Information

• Chemical Name: S-tert-Butyl 3-oxohept-6-enethioate
• CAS No.: 88939-05-3
• Molecular Formula: C11H18O2S
• Molecular Weight: 214.329
• DSSTox Substance ID: DTXSID80572078
• Nikkaji Number: J962.560G
• Wikidata: Q82460334

Synonyms:S-tert-Butyl 3-oxohept-6-enethioate;88939-05-3;DTXSID80572078

Chemical Property of S-tert-Butyl 3-oxohept-6-enethioate

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 214.10275099
• Heavy Atom Count: 14
• Complexity: 226

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)SC(=O)CC(=O)CCC=C

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