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CS-W001157 4
Total: USD 88.00

4,5,9,10-Tetrabromo-2,7-bis(2-octyldodecyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetraone

  • CAS No. 1219501-17-3

  • Cat. No. CS-0196594
  • Purity≥98%
  • MDL No.None

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

4,5,9,10-Tetrabromo-2,7-bis(2-octyldodecyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetraone|CS-0196594

Structure of 1219501-17-3

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General Information

  • CAS No. 1219501-17-3
  • Cat. No. CS-0196594
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅₄H₈₂Br₄N₂O₄
  • Molecular Weight 1142.86
  • Synonym(s) NDI812-4Br
  • SMILES O=C(N(CC(CCCCCCCC)CCCCCCCCCC)C(C1=C2C3=C(C(N4CC(CCCCCCCC)CCCCCCCCCC)=O)C(Br)=C1Br)=O)C2=C(Br)C(Br)=C3C4=O

Synthesis

  • Route1

    References

    • Steyrleuthner, Robert; Di Pietro, Riccardo; Collins, Brian A.; Polzer, Frank; Himmelberger, Scott; Schubert, Marcel; Chen, Zhihua; Zhang, Shiming; Salleo, Alberto; Ade, Harald; Facchetti, Antonio; Neher, Dieter Journal of the American Chemical Society, 2014 , vol. 136, # 11 p. 4245 - 4256
  • Route2

    References

    • Steyrleuthner, Robert; Di Pietro, Riccardo; Collins, Brian A.; Polzer, Frank; Himmelberger, Scott; Schubert, Marcel; Chen, Zhihua; Zhang, Shiming; Salleo, Alberto; Ade, Harald; Facchetti, Antonio; Neher, Dieter Journal of the American Chemical Society, 2014 , vol. 136, # 11 p. 4245 - 4256

Safety Information

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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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   78.14
  • LogP   17.9108
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   36

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