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(3aR,7aS)-5-Chloro-2-phenyl-2,3,3a,4,7,7a-hexahydro-1H-isoindole

Base Information
  • Chemical Name:(3aR,7aS)-5-Chloro-2-phenyl-2,3,3a,4,7,7a-hexahydro-1H-isoindole
  • CAS No.:56229-57-3
  • Molecular Formula:C14H16ClN
  • Molecular Weight:
  • Hs Code.:
  • DSSTox Substance ID:DTXSID00575889
  • Wikidata:Q82465332
(3aR,7aS)-5-Chloro-2-phenyl-2,3,3a,4,7,7a-hexahydro-1H-isoindole

Synonyms:56229-57-3;DTXSID00575889;(3aR,7aS)-5-Chloro-2-phenyl-2,3,3a,4,7,7a-hexahydro-1H-isoindole

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Chemical Property of (3aR,7aS)-5-Chloro-2-phenyl-2,3,3a,4,7,7a-hexahydro-1H-isoindole
Chemical Property:
  • XLogP3:3.8
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:1
  • Rotatable Bond Count:1
  • Exact Mass:233.0971272
  • Heavy Atom Count:16
  • Complexity:281
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C1C=C(CC2C1CN(C2)C3=CC=CC=C3)Cl
  • Isomeric SMILES:C1C=C(C[C@@H]2[C@H]1CN(C2)C3=CC=CC=C3)Cl
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