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CS-W001157 4
Total: USD 88.00

Undecan-3-one

  • CAS No. 2216-87-7

  • Cat. No. CS-0449664
  • Purity≥98%
  • MDL No.None

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

Undecan-3-one|CS-0449664

Structure of 2216-87-7

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General Information

  • CAS No. 2216-87-7
  • Cat. No. CS-0449664
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₂₂O
  • Molecular Weight 170.29
  • Synonym(s) Ethyl n-Octyl Ketone
  • SMILES CCCCCCCCC(=O)CC

Synthesis

  • Route1
    • (S)-Undecan-3-ol|CS-1229543
      79090-61-2
    • ~89%
    • Undecan-3-one|CS-0449664
      2216-87-7

    References

    • Csjernyik, Gabor; Ell, Alida H.; Fadini, Luca; Pugin, Benoit; Baeckvall, Jan-E. Journal of Organic Chemistry, 2002 , vol. 67, # 5 p. 1657 - 1662
  • Route2
    • null|null
      111-66-0
    • null|null
      123-38-6
    • ~73%
    • Undecan-3-one|CS-0449664
      2216-87-7

    References

    • Tsujimoto; Iwahama; Sakaguchi; Ishii Chemical Communications, 2001 , # 22 p. 2352 - 2353
  • Route3
    • null|null
      42832-47-3
    • ~30%
    • (S)-Undecan-3-ol|CS-1229543
      79090-61-2
    • Undecan-3-one|CS-0449664
      2216-87-7
    • null|null
      35329-42-1

    References

    • Organic Letters, , vol. 10, # 5 p. 1005 - 1008

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H315
Precautionary Statements : P210-P264-P280-P302+P352-P362+P364-P370+P378-P403-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.7161
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   8

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