s-Pyridin-2-yl octanethioate

Base Information

• Chemical Name: s-Pyridin-2-yl octanethioate
• CAS No.: 89397-99-9
• Molecular Formula: C13H19NOS
• Molecular Weight: 237.366
• DSSTox Substance ID: DTXSID20533087
• Wikidata: Q82406170
• Mol file: 89397-99-9.mol

Synonyms:s-pyridin-2-yl octanethioate;89397-99-9;Octanethioic acid, S-2-pyridinyl ester;SCHEMBL2912510;DTXSID20533087;JRVYPYKANCYOFX-UHFFFAOYSA-N;thiooctanoic acid-S-pyridin-2-yl ester

Chemical Property of s-Pyridin-2-yl octanethioate

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 237.11873540
• Heavy Atom Count: 16
• Complexity: 196

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCC(=O)SC1=CC=CC=N1