3-Ethyl-2-methyl-1-benzothiophene

Base Information

• Chemical Name: 3-Ethyl-2-methyl-1-benzothiophene
• CAS No.: 61612-04-2
• Molecular Formula: C11H12S
• DSSTox Substance ID: DTXSID70540524
• Wikidata: Q82416560

Synonyms:3-ethyl-2-methyl-1-benzothiophene;61612-04-2;SCHEMBL15450945;DTXSID70540524;3-ethyl-2-methyl-benzo[b]thiophene

Chemical Property of 3-Ethyl-2-methyl-1-benzothiophene

Chemical Property:

• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 176.06597156
• Heavy Atom Count: 12
• Complexity: 155

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=C(SC2=CC=CC=C21)C

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