2(1H)-Pyridinethione, 1-(2-methyl-1-oxopropoxy)-

Base Information

• Chemical Name: 2(1H)-Pyridinethione, 1-(2-methyl-1-oxopropoxy)-
• CAS No.: 89025-75-2
• Molecular Formula: C9H11NO2S
• Molecular Weight: 197.258
• DSSTox Substance ID: DTXSID70451262
• Nikkaji Number: J820.080G
• Wikidata: Q82271199

Synonyms:2(1H)-Pyridinethione, 1-(2-methyl-1-oxopropoxy)-;89025-75-2;SCHEMBL13390396;DTXSID70451262;N-(i-butanoyloxy)pyridine-2-thione;Isobutyric acid 2-thioxopyridin-1(2H)-yl ester

Chemical Property of 2(1H)-Pyridinethione, 1-(2-methyl-1-oxopropoxy)-

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 197.05104977
• Heavy Atom Count: 13
• Complexity: 281

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(=O)ON1C=CC=CC1=S

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