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CS-W001157 4
Total: USD 88.00

Terephthalonitrile

  • CAS No. 623-26-7

  • Cat. No. CS-0016004
  • Purity≥98%
  • MDL No.MFCD00001810

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

Terephthalonitrile|CS-0016004

Structure of 623-26-7

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General Information

  • CAS No. 623-26-7
  • Cat. No. CS-0016004
  • Purity ≥98%
  • MDL No. MFCD00001810
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₄N₂
  • Molecular Weight 128.13
  • Synonym(s) None
  • SMILES N#CC1=CC=C(C#N)C=C1

Description

benzyl N-[2-(prop-2-enamido)ethyl]carbamate is a short aliphatic linker featuring a Cbz-protected amine and an acrylamide. Acrylamide is a Michael acceptor which is a good Michael acceptor which can be used in thiol-based bioconjugation or polymerization. Meanwhile, the Cbz protecting group can be removed using Pd-C hydrogenation to reveal a free amine that can participate in a wide variety of reactions such as couplings or reductive amination.

Synthesis

  • Route1
    • null|null
      69386-99-8
    • ~96%
    • In-stock
      Terephthalonitrile|CS-0016004
      623-26-7

    References

    • Ghorbani-Vaghei, Ramin; Shiri, Lotfi; Ghorbani-Choghamarani, Arash Chinese Chemical Letters, 2013 , vol. 24, # 12 p. 1123 - 1126
  • Route2
    • null|null
      102437-81-0
    • ~86%
    • In-stock
      Terephthalonitrile|CS-0016004
      623-26-7

    References

    • Lamani, Manjunath; Prabhu, Kandikere Ramaiah Angewandte Chemie - International Edition, 2010 , vol. 49, # 37 p. 6622 - 6625
  • Route3
    • null|null
      106-42-3
    • ~90%
    • In-stock
      Terephthalonitrile|CS-0016004
      623-26-7

    References

    • MITSUBISHI GAS CHEMICAL COMPANY, INC. Patent: US2012/149933 A1, 2012 ; Location in patent: Page/Page column 8; 10 ;

Safety Information

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

Quality Control

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Computational Chemistry Data

  • TPSA   47.58
  • LogP   1.42996
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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