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CS-W001157 4
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5-Nitrofuran-2-carboxylic acid

  • CAS No. 645-12-5

  • Cat. No. CS-0040472
  • Purity≥95%
  • MDL No.MFCD00003240

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

5-Nitrofuran-2-carboxylic acid|CS-0040472

Structure of 645-12-5

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General Information

  • CAS No. 645-12-5
  • Cat. No. CS-0040472
  • Purity ≥95%
  • MDL No. MFCD00003240
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₃NO₅
  • Molecular Weight 157.08
  • Synonym(s) 5-nitrofuran-2-carboxylate
  • SMILES O=C(C1=CC=C([N+]([O-])=O)O1)O

Description

The FT-IR and FT-Raman spectra of 5-Nitro-2-furoic acid has been studied.5-Nitro-2-furoic acid was used in the preparation of [1,2,4]triazolo[3,4-b][1,3,4]thiadiazines and [1,2,4]triazolo[3,4-b][1,3,4] thiadiazoles.

Synthesis

  • Route1

    References

    • Dalcanale, Enrico; Montanari, Fernando Journal of Organic Chemistry, 1986 , vol. 51, # 4 p. 567 - 569
  • Route2
    • null|null
      69819-71-2
    • ~25%
    • In-stock
      5-Nitrofuran-2-carbonitrile|CS-0465940
      59-82-5
    • In-stock
      5-Nitrofuran-2-carboxylic acid|CS-0040472
      645-12-5

    References

    • Polish Journal of Chemistry, , vol. 80, # 3 p. 417 - 428
  • Route3

    References

    • Latvijas Adad. VestisChem.Abstr., , # 3 p. 49 Latvijas Adad. VestisChem.Abstr., , p. 6677

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS08
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H319-H341
Precautionary Statements : P264-P280-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   93.58
  • LogP   0.886
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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