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CS-W001157 4
Total: USD 88.00

6-Nitrobenzo[d][1,3]dioxol-5-ol

  • CAS No. 7107-10-0

  • Cat. No. CS-0314596
  • Purity≥97%
  • MDL No.None

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

6-Nitrobenzo[d][1,3]dioxol-5-ol|CS-0314596

Structure of 7107-10-0

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General Information

  • CAS No. 7107-10-0
  • Cat. No. CS-0314596
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅NO₅
  • Molecular Weight 183.12
  • Synonym(s) 6-Nitro-1,3-benzodioxol-5-ol
  • SMILES O=[N+](C1=C(O)C=C2OCOC2=C1)[O-]

Synthesis

  • Route1
    • (6-nitrobenzo[1,3]dioxol-5-yl) acetate|CS-0007380
      7107-08-6
    • ~%
    • 6-Nitrobenzo[d][1,3]dioxol-5-ol|CS-0314596
      7107-10-0

    References

    • Gertler et al. Journal of Organic Chemistry, 1959 , vol. 24, p. 327
  • Route2

    References

    • Arnold; Bordwell Journal of the American Chemical Society, 1942 , vol. 64, p. 2983,2985
  • Route3
    • Benzo[d][1,3]dioxol-5-yl acetate|CS-0155009
      326-58-9
    • ~%
    • 6-Nitrobenzo[d][1,3]dioxol-5-ol|CS-0314596
      7107-10-0

    References

    • Gertler et al. Journal of Organic Chemistry, 1959 , vol. 24, p. 327

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   81.83
  • LogP   1.0291
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   1

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