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2-Fluoro-5-(hexyl{[4-(phenylethynyl)phenyl]methyl}amino)benzoic acid

Base Information
  • Chemical Name:2-Fluoro-5-(hexyl{[4-(phenylethynyl)phenyl]methyl}amino)benzoic acid
  • CAS No.:866931-90-0
  • Molecular Formula:C28H28FNO2
  • Molecular Weight:
  • Hs Code.:
  • DSSTox Substance ID:DTXSID70581351
  • Wikidata:Q82472452
2-Fluoro-5-(hexyl{[4-(phenylethynyl)phenyl]methyl}amino)benzoic acid

Synonyms:866931-90-0;SCHEMBL1736180;DTXSID70581351;2-Fluoro-5-(hexyl{[4-(phenylethynyl)phenyl]methyl}amino)benzoic acid

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Chemical Property of 2-Fluoro-5-(hexyl{[4-(phenylethynyl)phenyl]methyl}amino)benzoic acid
Chemical Property:
  • XLogP3:7.5
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Rotatable Bond Count:11
  • Exact Mass:429.21040730
  • Heavy Atom Count:32
  • Complexity:624
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CCCCCCN(CC1=CC=C(C=C1)C#CC2=CC=CC=C2)C3=CC(=C(C=C3)F)C(=O)O
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