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CS-W001157 4
Total: USD 88.00

2-Methylenepentanedioic acid

  • CAS No. 3621-79-2

  • Cat. No. CS-0144510
  • Molecule weight144.13
  • Purity≥97%
  • MDL No.MFCD06208028

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

2-Methylenepentanedioic acid|CS-0144510

Structure of 3621-79-2

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General Information

  • CAS No. 3621-79-2
  • Cat. No. CS-0144510
  • Purity ≥97%
  • MDL No. MFCD06208028
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₈O₄
  • Molecular Weight 144.13
  • Synonym(s) 2-Methyleneglutaric acid
  • SMILES O=C(O)C(CCC(O)=O)=C

Synthesis

  • Route1
    • Dimethyl 2-methylenepentanedioate|CS-0966824
      5621-44-3
    • ~93%
    • 2-Methylenepentanedioic acid|CS-0144510
      3621-79-2

    References

    • Feng, Yan; Coward, James K. Journal of Medicinal Chemistry, 2006 , vol. 49, # 2 p. 770 - 788
  • Route2
    • null|null
      50-00-0
    • null|null
      105-53-3
    • ~%
    • 2-Methylenepentanedioic acid|CS-0144510
      3621-79-2

    References

    • Journal of the American Chemical Society, , vol. 64, p. 2705
  • Route3
    • null|null
      102714-67-0
    • ~%
    • 2-Methylenepentanedioic acid|CS-0144510
      3621-79-2

    References

    • Journal of the American Chemical Society, , vol. 124, # 47 p. 14039 - 14048

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   74.6
  • LogP   0.492
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   4

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