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CS-W001157 4
Total: USD 88.00

4-(4-Ethylpiperazin-1-yl)benzaldehyde

  • CAS No. 197638-76-9

  • Cat. No. CS-0213278
  • Purity≥98%
  • MDL No.MFCD05864670

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

4-(4-Ethylpiperazin-1-yl)benzaldehyde|CS-0213278

Structure of 197638-76-9

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General Information

  • CAS No. 197638-76-9
  • Cat. No. CS-0213278
  • Purity ≥98%
  • MDL No. MFCD05864670
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈N₂O
  • Molecular Weight 218.29
  • Synonym(s) 4-(4-ethyl-1-piperazin-4-iumyl)benzaldehyde
  • SMILES CCN1CCN(CC1)C2=CC=C(C=C2)C=O

Synthesis

  • Route1
    • 4-(4-Ethylpiperazino)benzonitrile|CS-0211925
      186650-78-2
    • ~%
    • In-stock
      4-(4-Ethylpiperazin-1-yl)benzaldehyde|CS-0213278
      197638-76-9

    References

    • Chemical and Pharmaceutical Bulletin, , vol. 45, # 9 p. 1458 - 1469
  • Route2
    • null|null
      5308-25-8
    • In-stock
      1-Bromo-4-(diethoxymethyl)benzene|CS-W010156
      34421-94-8
    • ~25%
    • In-stock
      4-(4-Ethylpiperazin-1-yl)benzaldehyde|CS-0213278
      197638-76-9

    References

    • Bavetsias, Vassilios; Crumpler, Simon; Sun, Chongbo; Avery, Sian; Atrash, Butrus; Faisal, Amir; Moore, Andrew S.; Brown, Nathan; Sheldrake, Peter W.; Bush, Katherine; Henley, Alan; Box, Gary; Valenti, Melanie; De Haven Brandon, Alexis; Raynaud, Florence I.; Workman, Paul; Eccles, Suzanne A.; Linardopoulos, Spiros; Blagg, Julian; Kosmopoulou, Magda; Bayliss, Richard Journal of Medicinal Chemistry, 2012 , vol. 55, # 20 p. 8721 - 8734,14 Title/Abstract Full Text Show Details Bavetsias, Vassilios; Crumpler, Simon; Sun, Chongbo; Avery, Sian; Atrash, Butrus; Faisal, Amir; Moore, Andrew S.; Kosmopoulou, Magda; Brown, Nathan; Sheldrake, Peter W.; Bush, Katherine; Henley, Alan; Box, Gary; Valenti, Melanie; De Haven Brandon, Alexis; Raynaud, Florence I.; Workman, Paul; Eccles, Suzanne A.; Bayliss, Richard; Linardopoulos, Spiros; Blagg, Julian Journal of Medicinal Chemistry, 2012 , vol. 55, # 20 p. 8721 - 8734
  • Route3

    References

    • Chemical and Pharmaceutical Bulletin, , vol. 45, # 9 p. 1458 - 1469

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

Quality Control

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Computational Chemistry Data

  • TPSA   23.55
  • LogP   1.641
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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