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CS-W001157 4
Total: USD 88.00

6-Nitrobenzo[de]isochromene-1,3-dione

  • CAS No. 6642-29-1

  • Cat. No. CS-0155691
  • Molecule weight243.17
  • Purity≥95%
  • MDL No.MFCD00013446

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

6-Nitrobenzo[de]isochromene-1,3-dione|CS-0155691

Structure of 6642-29-1

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General Information

  • CAS No. 6642-29-1
  • Cat. No. CS-0155691
  • Purity ≥95%
  • MDL No. MFCD00013446
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₅NO₅
  • Molecular Weight 243.17
  • Synonym(s) 4-Nitro-1,8-naphthalic anhydride
  • SMILES C1=CC2=C3C(=C1)C(=O)OC(=O)C3=CC=C2[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      602-87-9
    • ~92%
    • In-stock
      6-Nitrobenzo[de]isochromene-1,3-dione|CS-0155691
      6642-29-1

    References

    • Dong, Ming; Wang, Ya-Wen; Peng, Yu Organic Letters, 2010 , vol. 12, # 22 p. 5310 - 5313
  • Route2
    • null|null
      76980-79-5
    • ~75%
    • In-stock
      6-Nitrobenzo[de]isochromene-1,3-dione|CS-0155691
      6642-29-1

    References

    • Solodar', S. L.; Kochkin, V. A. Journal of Organic Chemistry USSR (English Translation), 1980 , vol. 16, # 10 p. 1820 - 1823 Zhurnal Organicheskoi Khimii, 1980 , vol. 16, # 10 p. 2137 - 2141
  • Route3
    • null|null
      10353-99-8
    • ~78%
    • In-stock
      6-Nitrobenzo[de]isochromene-1,3-dione|CS-0155691
      6642-29-1

    References

    • Dubey, Krishna K.; Singh, Ramendra K.; Misra, Krishna Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1995 , vol. 34, # 10 p. 876 - 878

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   86.51
  • LogP   2.0586
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   1

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