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3,3-Dimethylcyclobut-1-ene-1-carboxylic acid

  • CAS No. 37676-90-7

  • Cat. No. CS-0051617
  • Molecule weight126.15
  • Purity95+%
  • MDL No.None

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

3,3-Dimethylcyclobut-1-ene-1-carboxylic acid|CS-0051617

Structure of 37676-90-7

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General Information

  • CAS No. 37676-90-7
  • Cat. No. CS-0051617
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₀O₂
  • Molecular Weight 126.15
  • Synonym(s) 1-Cyclobutene-1-carboxylic acid, 3,3-dimethyl- (7CI,9CI)
  • SMILES CC1(C)CC(=C1)C(O)=O

Synthesis

  • Route1
    • null|null
      408314-33-0
    • ~%
    • 3,3-Dimethylcyclobut-1-ene-1-carboxylic acid|CS-0051617
      37676-90-7

    References

    • Campbell; Rydon Journal of the Chemical Society, 1953 , p. 3002,3005
  • Route2
    • null|null
      20104-44-3
    • ~%
    • 3,3-Dimethylcyclobut-1-ene-1-carboxylic acid|CS-0051617
      37676-90-7

    References

    • Beckwith, Athelstan L. J.; Moad, Graeme Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1980 , p. 1083 - 1092
  • Route3
    • null|null
      19251-73-1
    • ~%
    • 3,3-Dimethylcyclobut-1-ene-1-carboxylic acid|CS-0051617
      37676-90-7

    References

    • Brannock,K.C. et al. Journal of Organic Chemistry, 1964 , vol. 29, p. 801 - 812

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

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   1.4273
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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