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CS-W001157 4
Total: USD 88.00

3,4-Dibutoxycyclobut-3-ene-1,2-dione

  • CAS No. 2892-62-8

  • Cat. No. CS-0041921
  • Purity≥97%
  • MDL No.MFCD00037150

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

3,4-Dibutoxycyclobut-3-ene-1,2-dione|CS-0041921

Structure of 2892-62-8

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General Information

  • CAS No. 2892-62-8
  • Cat. No. CS-0041921
  • Purity ≥97%
  • MDL No. MFCD00037150
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₈O₄
  • Molecular Weight 226.27
  • Synonym(s) Squaric acid dibutylester
  • SMILES O=C1C(C(OCCCC)=C1OCCCC)=O

Description

3,4-Dibutoxy-3-cyclobutene-1,2-dione is the dialkyl ester of squaric acid.3,4-Dibutoxy-3-cyclobutene-1,2-dione was used in the synthesis of novel semisquarylium dye, useful for highly selective Hg2+ sensing in aqueous media. It was also employed in the synthesis of 3-butoxy-4-(1,3,3-trimethyl-2,3-dihydro-1H-2-indolylidenemethyl)-3-cyclobutene-1,2-dione, intermediate for the synthesis of squaryl dyes.

Synthesis

  • Route1
    • In-stock
      NSC 624671|CS-W019969
      2892-51-5
    • null|null
      71-36-3
    • ~92%
    • In-stock
      3,4-Dibutoxycyclobut-3-ene-1,2-dione|CS-0041921
      2892-62-8

    References

    • Canadian Journal of Chemistry, , vol. 64, p. 2267 - 2273
  • Route2
    • null|null
      3200-96-2
    • null|null
      71-36-3
    • ~65%
    • In-stock
      3,4-Dibutoxycyclobut-3-ene-1,2-dione|CS-0041921
      2892-62-8

    References

    • Chemische Berichte, , vol. 113, # 1 p. 1 - 8
  • Route3
    • Tributoxymethane|CS-0454025
      588-43-2
    • In-stock
      NSC 624671|CS-W019969
      2892-51-5
    • null|null
      71-36-3
    • ~97%
    • In-stock
      3,4-Dibutoxycyclobut-3-ene-1,2-dione|CS-0041921
      2892-62-8

    References

    • Synthetic Communications, , vol. 27, # 12 p. 2177 - 2180

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H317-H319-H335
Precautionary Statements : P261-P264-P271-P272-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   52.6
  • LogP   1.6404
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   8

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