Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide

Base Information

• Chemical Name: Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide
• CAS No.: 87947-59-9
• Molecular Formula: C12H24O3S2
• Molecular Weight: 280.44700
• DSSTox Substance ID: DTXSID50395392
• ChEMBL ID: CHEMBL1522667

Synonyms:87947-59-9;MLS000554344;Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide;CHEMBL1522667;DTXSID50395392;STK526984;AKOS005460239;SMR000146661;1,1-dioxidotetrahydrothiophen-3-yl octyl sulfoxide;3-(Octane-1-sulfinyl)-tetrahydro-thiophene 1,1-dioxide

Chemical Property of Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide

Chemical Property:

• PSA: 78.80000
• LogP: 4.22920
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 280.11668697
• Heavy Atom Count: 17
• Complexity: 330

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCS(=O)C1CCS(=O)(=O)C1

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