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CS-W001157 4
Total: USD 88.00

5-Chloro-3-methylpentan-2-one

  • CAS No. 1187-81-1

  • Cat. No. CS-0456904
  • Molecule weight134.60
  • Purity≥98%
  • MDL No.None

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

5-Chloro-3-methylpentan-2-one|CS-0456904

Structure of 1187-81-1

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General Information

  • CAS No. 1187-81-1
  • Cat. No. CS-0456904
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₁ClO
  • Molecular Weight 134.60
  • Synonym(s) 5-chloro-3-methyl-pentan-2-one
  • SMILES CC(C(C)CCCl)=O

Synthesis

  • Route1
    • null|null
      517-23-7
    • ~%
    • 5-Chloro-3-methylpentan-2-one|CS-0456904
      1187-81-1

    References

    • Cornish Christopher A.; Warren, Stuart Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1985 , p. 2585 - 2598
  • Route2

    References

    • Allen, Paul R.; Brimble, Margaret A.; Prabaharan, Hishani Journal of the Chemical Society. Perkin Transactions 1, 2001 , # 4 p. 379 - 389
  • Route3
    • null|null
      1124-92-1
    • ~65%
    • 5-Chloro-3-methylpentan-2-one|CS-0456904
      1187-81-1

    References

    • Balme, Genevieve; Gore, Jacques Journal of Organic Chemistry, 1983 , vol. 48, # 19 p. 3336 - 3338

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   1.8404
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   3

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