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CS-W001157 4
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4,5-diethoxy-2-nitro-Benzoic acid

  • CAS No. 103796-34-5

  • Cat. No. CS-0003927
  • Molecule weight255.22
  • Purity95+%
  • MDL No.MFCD11044852

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

4,5-diethoxy-2-nitro-Benzoic acid|CS-0003927

Structure of 103796-34-5

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General Information

  • CAS No. 103796-34-5
  • Cat. No. CS-0003927
  • Purity 95+%
  • MDL No. MFCD11044852
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃NO₆
  • Molecular Weight 255.22
  • Synonym(s) 4,5-Diethoxy-2-nitrobenzoic acid
  • SMILES OC(C1=CC(OCC)=C(C=C1[N+]([O-])=O)OCC)=O

Synthesis

  • Route1

    References

    • Rexahan Corporation Patent: US2005/187231 A1, 2005 ; Location in patent: Page/Page column 18 ;
  • Route2

    References

    • Acta Chimica Academiae Scientiarum Hungaricae, , vol. 17, p. 201,207
  • Route3
    • 4,5-Diethoxy-2-nitrobenzaldehyde|CS-0667310
      55149-82-1
    • ~%
    • 4,5-diethoxy-2-nitro-Benzoic acid|CS-0003927
      103796-34-5

    References

    • Acta Chimica Academiae Scientiarum Hungaricae, , vol. 17, p. 201,207

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   98.9
  • LogP   2.0904
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   6

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