2,5-Dimethylthiophene 1,1-dioxide

Base Information

• Chemical Name: 2,5-Dimethylthiophene 1,1-dioxide
• CAS No.: 50590-79-9
• Molecular Formula: C6H8O2S
• Molecular Weight: 144.194
• DSSTox Substance ID: DTXSID70480799
• Nikkaji Number: J820.833F
• Wikidata: Q82315879
• Mol file: 50590-79-9.mol

Synonyms:2,5-Dimethylthiophene 1,1-dioxide;50590-79-9;Thiophene, 2,5-dimethyl-, 1,1-dioxide;SCHEMBL4402331;DTXSID70480799

Chemical Property of 2,5-Dimethylthiophene 1,1-dioxide

Chemical Property:

• PSA: 42.52000
• LogP: 2.30320
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 144.02450067
• Heavy Atom Count: 9
• Complexity: 251

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(S1(=O)=O)C

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