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CS-W001157 4
Total: USD 88.00

2-Hexylmalonic acid

  • CAS No. 3974-36-5

  • Cat. No. CS-0581331
  • Molecule weight188.22
  • Purity≥98%
  • MDL No.None

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

2-Hexylmalonic acid|CS-0581331

Structure of 3974-36-5

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General Information

  • CAS No. 3974-36-5
  • Cat. No. CS-0581331
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₆O₄
  • Molecular Weight 188.22
  • Synonym(s) Hexylmalonic acid
  • SMILES CCCCCCC(C(=O)O)C(=O)O

Synthesis

  • Route1
    • null|null
      108127-84-0
    • ~%
    • 2-Hexylmalonic acid|CS-0581331
      3974-36-5

    References

    • Kuehnhanns; Teubel Journal fuer Praktische Chemie (Leipzig), 1955 , vol. <4>1, p. 87,93
  • Route2
    • null|null
      111-64-8
    • ~%
    • 2-Hexylmalonic acid|CS-0581331
      3974-36-5

    References

    • Kuehnhanns; Teubel Journal fuer Praktische Chemie (Leipzig), 1955 , vol. <4>1, p. 87,93
  • Route3
    • null|null
      92017-12-4
    • ~%
    • 2-Hexylmalonic acid|CS-0581331
      3974-36-5

    References

    • Uzu,K. et al. Journal of Antibiotics, Series A, 1961 , vol. 14, p. 209 - 214

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   1.7422
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   7

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