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CS-W001157 4
Total: USD 88.00

3-Methyloctanoic acid

  • CAS No. 6061-10-5

  • Cat. No. CS-0264558
  • Molecule weight158.24
  • Purity≥98%
  • MDL No.None

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

3-Methyloctanoic acid|CS-0264558

Structure of 6061-10-5

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General Information

  • CAS No. 6061-10-5
  • Cat. No. CS-0264558
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₈O₂
  • Molecular Weight 158.24
  • Synonym(s) DL-3-Methyl-octansaeure
  • SMILES CCCCCC(C)CC(O)=O

Synthesis

  • Route1
    • null|null
      64-18-6
    • null|null
      15870-10-7
    • ~62%
    • 3-Methyloctanoic acid|CS-0264558
      6061-10-5

    References

    • Ali, B. El; Vasapollo, G.; Alper, H. Journal of Organic Chemistry, 1993 , vol. 58, # 17 p. 4739 - 4741
  • Route2

    References

    • Ali, B. El; Vasapollo, G.; Alper, H. Journal of Organic Chemistry, 1993 , vol. 58, # 17 p. 4739 - 4741
  • Route3
    • Methyl 2-Octynoate, ≥99%, stabilized|CS-1268665
      111-12-6
    • ~%
    • 3-Methyloctanoic acid|CS-0264558
      6061-10-5

    References

    • Carpita, Adriano; Magistris, Elisabetta De; Rossi, Renzo Gazzetta Chimica Italiana, 1989 , vol. 119, # 2 p. 99 - 106

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H315-H318-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.6775
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   6

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