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CS-W001157 4
Total: USD 88.00

NPN12830

  • CAS No. 22112-83-0

  • Cat. No. CS-0085915
  • Purity≥96%
  • MDL No.MFCD00218869

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

NPN12830|CS-0085915

Structure of 22112-83-0

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General Information

  • CAS No. 22112-83-0
  • Cat. No. CS-0085915
  • Purity ≥96%
  • MDL No. MFCD00218869
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅₂H₃₈N₄O₈
  • Molecular Weight 846.88
  • Synonym(s) None
  • SMILES O=C(C1=CC=C(/C2=C3C=CC(/C(C4=CC=C(C(OC)=O)C=C4)=C(N/5)/C=CC5=C(C6=CC=C(C(OC)=O)C=C6)\C7=N/C(C=C7)=C(C8=CC=C(C(OC)=O)C=C8)\C9=CC=C2N9)=N\3)C=C1)OC

Synthesis

  • Route1
    • null|null
      109-97-7
    • In-stock
      Methyl 4-formylbenzoate|CS-W009013
      1571-08-0
    • ~29%
    • In-stock
      NPN12830|CS-0085915
      22112-83-0

    References

    • Rochford, Jonathan; Chu, Dorothy; Hagfeldt, Anders; Galoppini, Elena Journal of the American Chemical Society, 2007 , vol. 129, # 15 p. 4655 - 4665
  • Route2

    References

    • Lindsey, Jonathan S.; Schreiman, Irwin C.; Hsu, Henry C.; Kearney, Patrick C.; Marguerettaz, Anne M. Journal of Organic Chemistry, 1987 , vol. 52, # 5 p. 827 - 836
  • Route3
    • null|null
      109-97-7
    • null|null
      802294-64-0
    • In-stock
      Methyl 4-formylbenzoate|CS-W009013
      1571-08-0
    • ~21%
    • In-stock
      NPN12830|CS-0085915
      22112-83-0

    References

    • Feng, Dawei; Gu, Zhi-Yuan; Li, Jian-Rong; Jiang, Hai-Long; Wei, Zhangwen; Zhou, Hong-Cai Angewandte Chemie, International Edition, 2012 , vol. 51, # 41 p. 10307 - 10310,4 Angewandte Chemie, 2011 , vol. 124, # 41 p. 10453 - 10456,4 Title/Abstract Full Text Show Details Feng, Dawei; Gu, Zhi-Yuan; Li, Jian-Rong; Jiang, Hai-Long; Wei, Zhangwen; Zhou, Hong-Cai Angewandte Chemie - International Edition, 2012 , vol. 51, # 41 p. 10307 - 10310 Angew. Chem., 2011 , vol. 124, # 41 p. 10453 - 10456,4

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-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   162.56
  • LogP   10.6844
  • H_Acceptors   10
  • H_Donors   2
  • Rotatable_Bonds   8

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