Toloconium metilsulfate

Base Information

• Chemical Name: Toloconium metilsulfate
• CAS No.: 552-92-1
• Molecular Formula: C23H43NO4S
• Molecular Weight: 429.662
• European Community (EC) Number: 209-026-9
• UNII: ERT0485MCD
• DSSTox Substance ID: DTXSID70970529
• Wikidata: Q27277327
• NCI Thesaurus Code: C152686
• ChEMBL ID: CHEMBL2107671
• Mol file: 552-92-1.mol

Synonyms:toloconium methylsulfate;trimethyl(1-p-tolyldodecyl)ammonium methyl sulfate

Chemical Property of Toloconium metilsulfate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 74.81000
• Density: g/cm³
• LogP: 6.83700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 12
• Exact Mass: 429.29128003
• Heavy Atom Count: 29
• Complexity: 361

Purity/Quality:

99% ^*data from raw suppliers

TOLOCONIUM METILSULFATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCC(C1=CC=C(C=C1)C)[N+](C)(C)C.COS(=O)(=O)[O-]