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CS-W001157 4
Total: USD 88.00

2,9-Di(tridecan-7-yl)anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetraone

  • CAS No. 110590-84-6

  • Cat. No. CS-0187871
  • Purity≥97%
  • MDL No.None

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

2,9-Di(tridecan-7-yl)anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetraone|CS-0187871

Structure of 110590-84-6

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General Information

  • CAS No. 110590-84-6
  • Cat. No. CS-0187871
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅₀H₆₂N₂O₄
  • Molecular Weight 755.04
  • Synonym(s) 2,9-BIS-(1-HEXYLHEPTYL)ANTHRA[2,1,9-DEF ,6,5,10-D\'E\'F\']DIISOQUINOLINE-1,3,8,10-TETRAONE
  • SMILES O=C(C(C1=C2C=CC3=C41)=CC=C4C5=CC=C6C7=C5C3=CC=C7C(N(C(CCCCCC)CCCCCC)C6=O)=O)N(C(CCCCCC)CCCCCC)C2=O

Synthesis

  • Route1

    References

    • Organic and Biomolecular Chemistry, , vol. 5, # 23 p. 3762 - 3768
  • Route2

    References

    • Journal of the American Chemical Society, , vol. 125, # 41 p. 12649 - 12654
  • Route3
    • In-stock
      Tridecan-7-amine|CS-0468403
      22513-16-2
    • ~%
    • null|null
      1274451-95-4
    • In-stock
      2,9-Di(tridecan-7-yl)anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetraone|CS-0187871
      110590-84-6

    References

    • European Journal of Organic Chemistry, , # 4 p. 707 - 712

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   78.14
  • LogP   12.9268
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   22

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