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CS-W001157 4
Total: USD 88.00

1-Chlorooctan-4-one

  • CAS No. 80086-19-7

  • Cat. No. CS-0297386
  • Molecule weight162.66
  • Purity≥95%
  • MDL No.None

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

1-Chlorooctan-4-one|CS-0297386

Structure of 80086-19-7

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General Information

  • CAS No. 80086-19-7
  • Cat. No. CS-0297386
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₅ClO
  • Molecular Weight 162.66
  • Synonym(s) 4-Octanone,1-chloro
  • SMILES CCCCC(CCCCl)=O

Synthesis

  • Route1
    • null|null
      693-04-9
    • null|null
      4635-59-0
    • ~83%
    • 1-Chlorooctan-4-one|CS-0297386
      80086-19-7

    References

    • Cahiez, Gerard Tetrahedron Letters, 1992 , vol. 33, # 31 p. 4439 - 4442
  • Route2
    • null|null
      110808-11-2
    • ~80%
    • 1-Chlorooctan-4-one|CS-0297386
      80086-19-7

    References

    • Khusid, A. Kh. Journal of Organic Chemistry USSR (English Translation), 1987 , vol. 23, p. 112 - 115 Zhurnal Organicheskoi Khimii, 1987 , vol. 23, # 1 p. 126 - 129
  • Route3
    • 1-Hydroxyoctan-4-one|CS-1023060
      16378-50-0
    • ~89%
    • 1-Chlorooctan-4-one|CS-0297386
      80086-19-7

    References

    • Matveeva; Kvasha; Kurts Russian Journal of Organic Chemistry, 1996 , vol. 32, # 1 p. 21 - 24

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS08
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331-H341
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.7647
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   6

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