7-Methyl-3,4-dihydro-1-benzothiepin-5(2H)-one

Base Information

• Chemical Name: 7-Methyl-3,4-dihydro-1-benzothiepin-5(2H)-one
• CAS No.: 18850-47-0
• Molecular Formula: C₁₁H₁₂OS
• Molecular Weight: 192.282
• DSSTox Substance ID: DTXSID20503886
• Nikkaji Number: J1.334.592I
• Wikidata: Q82357978

Synonyms:18850-47-0;7-Methyl-3,4-dihydro-1-benzothiepin-5(2H)-one;DTXSID20503886

Chemical Property of 7-Methyl-3,4-dihydro-1-benzothiepin-5(2H)-one

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 192.06088618
• Heavy Atom Count: 13
• Complexity: 202

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)SCCCC2=O

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