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CS-W001157 4
Total: USD 88.00

4-Methyl-2-methylenepentanoic acid

  • CAS No. 25044-10-4

  • Cat. No. CS-0146225
  • Molecule weight128.17
  • Purity≥95%
  • MDL No.MFCD00797959

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

4-Methyl-2-methylenepentanoic acid|CS-0146225

Structure of 25044-10-4

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General Information

  • CAS No. 25044-10-4
  • Cat. No. CS-0146225
  • Purity ≥95%
  • MDL No. MFCD00797959
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₂O₂
  • Molecular Weight 128.17
  • Synonym(s) 4-Methyl-2-methylene valeric acid
  • SMILES CC(CC(C(O)=O)=C)C

Synthesis

  • Route1
    • Ethyl 4-methyl-2-methylenepentanoate|CS-0368345
      87438-94-6
    • ~10%
    • 4-Methyl-2-methylenepentanoic acid|CS-0146225
      25044-10-4

    References

    • BOREALIS AG; CASTRO, Pascal; RESCONI, Luigi; HUHTANEN, Lauri Patent: WO2012/1051 A1, 2012 ; Location in patent: Page/Page column 39 ;
  • Route2
    • null|null
      50-00-0
    • Isobutylmalonic Acid|CS-0770957
      4361-06-2
    • ~10%
    • 4-Methyl-2-methylenepentanoic acid|CS-0146225
      25044-10-4

    References

    • Kummer, David A.; Chain, William J.; Morales, Marvin R.; Quiroga, Olga; Myers, Andrew G. Journal of the American Chemical Society, 2008 , vol. 130, # 40 p. 13231 - 13233
  • Route3

    References

    • Syntex (U.S.A.) Inc. Patent: US6037472 A1, 2000 ;

Safety Information

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Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   1.6733
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   3

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