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CS-W001157 4
Total: USD 88.00

(6-nitrobenzo[1,3]dioxol-5-yl) acetate

  • CAS No. 7107-08-6

  • Cat. No. CS-0007380
  • Purity≥98%
  • MDL No.MFCD07658172

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

(6-nitrobenzo[1,3]dioxol-5-yl) acetate|CS-0007380

Structure of 7107-08-6

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General Information

  • CAS No. 7107-08-6
  • Cat. No. CS-0007380
  • Purity ≥98%
  • MDL No. MFCD07658172
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₆
  • Molecular Weight 225.15
  • Synonym(s) 6-Nitro-1,3-benzodioxol-5-yl acetate
  • SMILES O=C(C)OC1=C([N+]([O-])=O)C=C(OCO2)C2=C1

Synthesis

  • Route1
    • Benzo[d][1,3]dioxol-5-yl acetate|CS-0155009
      326-58-9
    • ~%
    • (6-nitrobenzo[1,3]dioxol-5-yl) acetate|CS-0007380
      7107-08-6

    References

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

Safety Information

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Computational Chemistry Data

  • TPSA   87.9
  • LogP   1.2488
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   2

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