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1,7-Dichloroheptan-4-one

  • CAS No. 40624-07-5

  • Cat. No. CS-W018764
  • Molecule weight183.08
  • Purity≥96%
  • MDL No.MFCD00019001

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

1,7-Dichloroheptan-4-one|CS-W018764

Structure of 40624-07-5

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General Information

  • CAS No. 40624-07-5
  • Cat. No. CS-W018764
  • Purity ≥96%
  • MDL No. MFCD00019001
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₂Cl₂O
  • Molecular Weight 183.08
  • Synonym(s) 1,7-DICHLOROHEPTANE-4-ONE
  • SMILES C(C(CCCCl)=O)CCCl

Description

1,7-Dichloroheptan-4-one features a symmetrically substituted aliphatic backbone with chlorine atoms at terminal positions and a ketone group at the central carbon. This configuration imparts enhanced stability and reactivity for use in synthetic organic transformations, particularly in constructing complex molecular frameworks under mild conditions.

Synthesis

  • Route1

    References

    • Brethous, Lise; Garcia-Delgado, Noemi; Schwartz, Julian; Bertrand, Sonia; Bertrand, Daniel; Reymond, Jean-Louis Journal of Medicinal Chemistry, 2012 , vol. 55, # 10 p. 4605 - 4618
  • Route2
    • In-stock
      Dicyclopropylketone|CS-0076033
      1121-37-5
    • ~19%
    • In-stock
      1,7-Dichloroheptan-4-one|CS-W018764
      40624-07-5
    • 4-Chloro-1-cyclopropylbutan-1-one|CS-0597817
      98430-99-0

    References

    • Rakhmatullina, L. Kh.; Markevich, V. S.; Lipkin, M. A. Journal of Organic Chemistry USSR (English Translation), 1991 , vol. 27, # 11.2 p. 2184 - 2185 Zhurnal Organicheskoi Khimii, 1991 , vol. 27, # 11 p. 2458 - 2459
  • Route3
    • null|null
      96-48-0
    • null|null
      124-41-4
    • ~%
    • In-stock
      1,7-Dichloroheptan-4-one|CS-W018764
      40624-07-5

    References

    • Hart; Curtis Journal of the American Chemical Society, 1956 , vol. 78, p. 112,115 Full Text Show Details Curtis et al. Org.Synt.Coll.Vol.IV<1963>278

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

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.5935
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   6

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