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CS-W001157 4
Total: USD 88.00

2-(3-Nitrophenyl)benzoic acid

  • CAS No. 37174-74-6

  • Cat. No. CS-0206746
  • Molecule weight243.21
  • Purity≥98%
  • MDL No.MFCD06803019

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

2-(3-Nitrophenyl)benzoic acid|CS-0206746

Structure of 37174-74-6

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General Information

  • CAS No. 37174-74-6
  • Cat. No. CS-0206746
  • Purity ≥98%
  • MDL No. MFCD06803019
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₉NO₄
  • Molecular Weight 243.21
  • Synonym(s) OTAVA-BB 1363645
  • SMILES C1=CC=C(C(=C1)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

Synthesis

  • Route1

    References

    • Tao, Bin; Goel, Subhash C.; Singh, Jagvir; Boykin, David W. Synthesis, 2002 , # 8 p. 1043 - 1046
  • Route2
    • Methyl 2-(3-nitrophenyl)benzoate|CS-0210928
      83527-96-2
    • ~%
    • 2-(3-Nitrophenyl)benzoic acid|CS-0206746
      37174-74-6

    References

    • Kenner et al. Tetrahedron, 1957 , vol. 1, p. 259,267
  • Route3

    References

    • Tao, Bin; Goel, Subhash C.; Singh, Jagvir; Boykin, David W. Synthesis, 2002 , # 8 p. 1043 - 1046

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   80.44
  • LogP   2.96
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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