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CS-W001157 4
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6-Methylisoindolin-1-one

  • CAS No. 58083-55-9

  • Cat. No. CS-0312978
  • Molecule weight147.17
  • Purity≥97%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

6-Methylisoindolin-1-one|CS-0312978

Structure of 58083-55-9

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General Information

  • CAS No. 58083-55-9
  • Cat. No. CS-0312978
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO
  • Molecular Weight 147.17
  • Synonym(s) 6-Methylphthalimidine
  • SMILES CC1=CC2=C(CNC2=O)C=C1

Synthesis

  • Route1
    • null|null
      65608-85-7
    • ~73%
    • 6-Methylisoindolin-1-one|CS-0312978
      58083-55-9

    References

    • Smith, Keith; El-Hiti, Gamal A.; Hegazy, Amany S.; Kariuki, Benson Beilstein Journal of Organic Chemistry, 2011 , vol. 7, art. no. 142, p. 1219 - 1227
  • Route2
    • Tert-butyl[(4-methylphenyl)methyl]amine|CS-0236060
      55980-45-5
    • ~%
    • 6-Methylisoindolin-1-one|CS-0312978
      58083-55-9

    References

    • Lopez-Valdez, German; Olguin-Uribe, Simon; Millan-Ortiz, Alejandra; Gamez-Montano, Rocio; Miranda, Luis D. Tetrahedron, 2011 , vol. 67, # 14 p. 2693 - 2701
  • Route3

    References

    • de Diesbach Helvetica Chimica Acta, 1940 , vol. 23, p. 1232,1252

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   29.1
  • LogP   1.23842
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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