4,6-Bis(methylsulfanyl)-5H-5lambda~4~-thianthren-5-one

Base Information

• Chemical Name: 4,6-Bis(methylsulfanyl)-5H-5lambda~4~-thianthren-5-one
• CAS No.: 135489-40-6
• Molecular Formula: C₁₄H₁₂OS₄
• Molecular Weight: 324.513
• DSSTox Substance ID: DTXSID90566286
• Wikidata: Q82451841
• Mol file: 135489-40-6.mol

Synonyms:135489-40-6;4,6-Bis(methylsulfanyl)-5H-5lambda~4~-thianthren-5-one;DTXSID90566286

Chemical Property of 4,6-Bis(methylsulfanyl)-5H-5lambda~4~-thianthren-5-one

Chemical Property:

• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 323.97709970
• Heavy Atom Count: 19
• Complexity: 318

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC1=CC=CC2=C1S(=O)C3=C(S2)C=CC=C3SC