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CS-W001157 4
Total: USD 88.00

4-Nitrocatechol

  • CAS No. 3316-09-4

  • Cat. No. CS-0058406
  • Purity≥96%
  • MDL No.None

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

4-Nitrocatechol|CS-0058406

Structure of 3316-09-4

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General Information

  • CAS No. 3316-09-4
  • Cat. No. CS-0058406
  • Purity ≥96%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₅NO₄
  • Molecular Weight 155.11
  • Synonym(s) None
  • SMILES OC1=CC=C([N+]([O-])=O)C=C1O

Description

4-Nitrocatechol features a catechol core bearing a nitro group at the para position, delivering enhanced electron-withdrawing character. This arrangement facilitates redox-active coordination in metal complexation and enables selective reactivity in oxidative coupling processes. The molecule exhibits bench-stable behavior under standard conditions, supporting its use in synthetic transformations requiring controlled phenolic functionality.

Synthesis

  • Route1
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      4-Nitrocatechol|CS-0058406
      3316-09-4

    References

    • Environmental Science & Technology, , vol. 28, # 2 p. 306 - 311
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      120-80-9
    • ~%
    • In-stock
      4-Nitrocatechol|CS-0058406
      3316-09-4

    References

    • Chemische Berichte, , vol. 11, p. 362
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      100-02-7
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      4-Nitrocatechol|CS-0058406
      3316-09-4
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      123-31-9

    References

    • Journal of the American Chemical Society, , vol. 131, # 12 p. 4397 - 4404

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-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   83.6
  • LogP   1.006
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   1

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