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CS-W001157 4
Total: USD 88.00

4-Ethynylisoquinoline

  • CAS No. 78593-42-7

  • Cat. No. CS-0308486
  • Molecule weight153.18
  • Purity95+%
  • MDL No.None

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

4-Ethynylisoquinoline|CS-0308486

Structure of 78593-42-7

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General Information

  • CAS No. 78593-42-7
  • Cat. No. CS-0308486
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₇N
  • Molecular Weight 153.18
  • Synonym(s) 4-ethynyl-isoquinoline
  • SMILES C#CC1=CN=CC2=CC=CC=C12

Synthesis

  • Route1
    • 4-((Trimethylsilyl)ethynyl)isoquinoline|CS-0589066
      86549-28-2
    • ~95%
    • 4-Ethynylisoquinoline|CS-0308486
      78593-42-7

    References

    • Samsung Display Co., Ltd.; Park, Bum-Woo; Kwak , Yoon-Hyun; Lee, Sun-Young; Cho, Se-Jin Patent: EP2666768 A2, 2013 ; Location in patent: Paragraph 0133; 0135 ;
  • Route2
    • null|null
      78610-69-2
    • ~67%
    • 4-Ethynylisoquinoline|CS-0308486
      78593-42-7

    References

    • Ames, D. E.; Bull, D.; Takundwa, C. Synthesis, 1981 , # 5 p. 364 - 365
  • Route3

    References

    • Ames, D. E.; Bull, D.; Takundwa, C. Synthesis, 1981 , # 5 p. 364 - 365

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-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   12.89
  • LogP   2.2161
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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