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CS-W001157 4
Total: USD 88.00

5-Nitro-1,3-dihydroisobenzofuran

  • CAS No. 52771-99-0

  • Cat. No. CS-0038795
  • Purity≥97%
  • MDL No.None

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

5-Nitro-1,3-dihydroisobenzofuran|CS-0038795

Structure of 52771-99-0

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General Information

  • CAS No. 52771-99-0
  • Cat. No. CS-0038795
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇NO₃
  • Molecular Weight 165.15
  • Synonym(s) 5-Nitrophthalan
  • SMILES C1=C2COCC2=CC(=C1)[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      1013915-62-2
    • ~57%
    • In-stock
      5-Nitro-1,3-dihydroisobenzofuran|CS-0038795
      52771-99-0

    References

    • Eisai RandD Management Co., Ltd. Patent: EP2062901 A1, 2009 ; Location in patent: Page/Page column 19 ;
  • Route2

    References

    • Merck and Co., Inc. Patent: US4144341 A1, 1979 ;

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
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   52.37
  • LogP   1.625
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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