1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-

Base Information

• Chemical Name: 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-
• CAS No.: 34005-00-0
• Molecular Formula: C6H12 O4 S3
• Molecular Weight: 244.3521
• DSSTox Substance ID: DTXSID10187614
• Wikidata: Q83059320
• Mol file: 34005-00-0.mol

Synonyms:34005-00-0;1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-;3-((Ethoxycarbonothioyl)thio)propane-1-sulfonic acid;1-Propanesulfonic acid, 3-[(ethoxythioxomethyl)thio]-;SCHEMBL565326;C6H12O4S3;DTXSID10187614;C6-H12-O4-S3

Chemical Property of 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-

Chemical Property:

• PSA: 129.37000
• Density: 1.425g/cm³
• LogP: 2.39970
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 243.98977238
• Heavy Atom Count: 13
• Complexity: 241

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=S)SCCCS(=O)(=O)O