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CS-W001157 4
Total: USD 88.00

6,6-Dimethylheptanoic acid

  • CAS No. 15898-92-7

  • Cat. No. CS-0239262
  • Molecule weight158.24
  • Purity≥95%
  • MDL No.None

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

6,6-Dimethylheptanoic acid|CS-0239262

Structure of 15898-92-7

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General Information

  • CAS No. 15898-92-7
  • Cat. No. CS-0239262
  • Purity ≥95%
  • 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) neononanoic acid
  • SMILES CC(C)(C)CCCCC(O)=O

Synthesis

  • Route1
    • null|null
      87253-07-4
    • ~%
    • 6,6-Dimethylheptanoic acid|CS-0239262
      15898-92-7

    References

    • Lynch,E.R.; McCall,E.B. Journal of the Chemical Society, 1960 , p. 1254 - 1262
  • Route2
    • 1-Bromo-4,4-dimethylpentane|CS-0235467
      6570-95-2
    • ~%
    • 6,6-Dimethylheptanoic acid|CS-0239262
      15898-92-7

    References

    • Lynch,E.R.; McCall,E.B. Journal of the Chemical Society, 1960 , p. 1254 - 1262
  • Route3

    References

    • Sy et al. Journal of the Chemical Society, 1954 , p. 1975,1977

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3265
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P304+P340-P363-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.6775
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   4

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