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5-Oxo-2,3,4,5-tetrahydro-1-benzothiepine-4-carbonitrile

Base Information
  • Chemical Name:5-Oxo-2,3,4,5-tetrahydro-1-benzothiepine-4-carbonitrile
  • CAS No.:88267-23-6
  • Molecular Formula:C11H9NOS
  • Molecular Weight:203.265
  • Hs Code.:
  • DSSTox Substance ID:DTXSID60520719
5-Oxo-2,3,4,5-tetrahydro-1-benzothiepine-4-carbonitrile

Synonyms:5-oxo-2,3,4,5-tetrahydro-1-benzothiepine-4-carbonitrile;88267-23-6;DTXSID60520719;5-oxo-3,4-dihydro-2H-[1]benzothiepine-4-carbonitrile

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Chemical Property of 5-Oxo-2,3,4,5-tetrahydro-1-benzothiepine-4-carbonitrile
Chemical Property:
  • XLogP3:2.3
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Rotatable Bond Count:0
  • Exact Mass:203.04048508
  • Heavy Atom Count:14
  • Complexity:280
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C1CSC2=CC=CC=C2C(=O)C1C#N
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