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CS-W001157 4
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5H-Dibenzo[b,e]azepine-6,11-dione

  • CAS No. 1143-50-6

  • Cat. No. CS-0149739
  • Purity≥96%
  • MDL No.MFCD00612476

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

5H-Dibenzo[b,e]azepine-6,11-dione|CS-0149739

Structure of 1143-50-6

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General Information

  • CAS No. 1143-50-6
  • Cat. No. CS-0149739
  • Purity ≥96%
  • MDL No. MFCD00612476
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₉NO₂
  • Molecular Weight 223.23
  • Synonym(s) 5H-Dibenzo(B,E)azepine-6,11-dione
  • SMILES O=C1C2=CC=CC=C2NC(C3=CC=CC=C13)=O

Description

5H-Dibenzo[b,e]azepine-6,11-dione features a rigid, planar heteroaromatic core with two electron-deficient carbonyl groups at the 6 and 11 positions. This structural motif enables integration into conjugated systems for materials science applications, while its stability under standard conditions supports use in synthetic intermediates and medicinal chemistry.

Application

5H-Dibenzo[b,e]azepine-6,11-dione serves as a versatile heterocyclic building block for medicinal chemistry and materials science applications. Its rigid, polycyclic structure exhibits excellent bench stability and functions as a core scaffold in the synthesis of bioactive molecules. The diketone moiety enables diverse transformations including nucleophilic additions and condensation reactions, facilitating the construction of complex architectures with predictable regiochemistry.

Synthesis

  • Route1

    References

    • AKZO NOBEL N.V. Patent: WO2007/25938 A1, 2007 ; Location in patent: Page/Page column 13 ; WO 2007/025938 A1
  • Route2

    References

    • DE258343 ; Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 11, p. 565
  • Route3

    References

    • Qin, Chong; Zhou, Wang; Chen, Feng; Ou, Yang; Jiao, Ning Angewandte Chemie - International Edition, 2011 , vol. 50, # 52 p. 12595 - 12599

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-H332-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   49.93
  • LogP   2.0415
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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