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CS-W001157 4
Total: USD 88.00

Methyl 4-formyl-3-nitrobenzoate

  • CAS No. 153813-69-5

  • Cat. No. CS-M1229
  • Purity≥97%
  • MDL No.MFCD04039968

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

Methyl 4-formyl-3-nitrobenzoate|CS-M1229

Structure of 153813-69-5

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General Information

  • CAS No. 153813-69-5
  • Cat. No. CS-M1229
  • Purity ≥97%
  • MDL No. MFCD04039968
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₅
  • Molecular Weight 209.16
  • Synonym(s) 4-Formyl-3-nitrobenzoic Acid Methyl Ester
  • SMILES O=C(OC)C1=CC=C(C=O)C([N+]([O-])=O)=C1

Synthesis

  • Route1
    • null|null
      104447-80-5
    • ~97%
    • In-stock
      Methyl 4-formyl-3-nitrobenzoate|CS-M1229
      153813-69-5

    References

    • Tetrahedron Letters, , vol. 35, # 2 p. 219 - 222
  • Route2
    • Methyl 4-(bromomethyl)-3-nitrobenzoate|CS-0695998
      88089-94-5
    • ~67%
    • In-stock
      Methyl 4-formyl-3-nitrobenzoate|CS-M1229
      153813-69-5

    References

    • WO2005/66136 A1, ; Page/Page column 93-94 ; WO 2005/066136 A1
  • Route3

    References

    • Tetrahedron Letters, , vol. 35, # 2 p. 219 - 222

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   86.51
  • LogP   1.1939
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   3

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