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CS-W001157 4
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Ethyl 4-hydroxy-3-nitrobenzoate

  • CAS No. 19013-10-6

  • Cat. No. CS-0116977
  • Molecule weight211.17
  • Purity≥98%
  • MDL No.None

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

Ethyl 4-hydroxy-3-nitrobenzoate|CS-0116977

Structure of 19013-10-6

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General Information

  • CAS No. 19013-10-6
  • Cat. No. CS-0116977
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO₅
  • Molecular Weight 211.17
  • Synonym(s) 4-Hydroxy-3-nitrobenzoic acid ethyl ester
  • SMILES O=C(OCC)C1=CC=C(O)C([N+]([O-])=O)=C1

Synthesis

  • Route1
    • Ethyl 4-hydroxybenzoate Erlotinib Impurity|CS-0167068
      120-47-8
    • ~%
    • Ethyl 4-hydroxy-3-nitrobenzoate|CS-0116977
      19013-10-6

    References

    • Journal fuer Praktische Chemie (Leipzig), , vol. <2> 43, p. 464
  • Route2

    References

    • Tetrahedron Letters, , vol. 48, # 3 p. 473 - 476
  • Route3

    References

    • Journal of Organic Chemistry, , vol. 75, # 18 p. 6154 - 6162

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H317-H319
Precautionary Statements : P261-P264-P272-P280-P302+P352-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   89.67
  • LogP   1.4771
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   3

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