S-Butyl heptanethioate

Base Information

• Chemical Name: S-Butyl heptanethioate
• CAS No.: 116074-61-4
• Molecular Formula: C11H22OS
• DSSTox Substance ID: DTXSID90554108
• Wikidata: Q82434947
• Mol file: 116074-61-4.mol

Synonyms:S-Butyl heptanethioate;116074-61-4;SCHEMBL9770398;DTXSID90554108

Chemical Property of S-Butyl heptanethioate

Chemical Property:

• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 202.13913649
• Heavy Atom Count: 13
• Complexity: 123

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(=O)SCCCC