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CS-W001157 4
Total: USD 88.00

Heptane-2,5-dione

  • CAS No. 1703-51-1

  • Cat. No. CS-0211119
  • Purity98+%
  • MDL No.MFCD07437947

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

Heptane-2,5-dione|CS-0211119

Structure of 1703-51-1

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General Information

  • CAS No. 1703-51-1
  • Cat. No. CS-0211119
  • Purity 98+%
  • MDL No. MFCD07437947
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₂O₂
  • Molecular Weight 128.17
  • Synonym(s) 2,5-Heptanedione
  • SMILES CCC(=O)CCC(=O)C

Synthesis

  • Route1
    • null|null
      42397-31-9
    • ~92%
    • Heptane-2,5-dione|CS-0211119
      1703-51-1

    References

    • Mikolajczyk, Marian; Midura, Wanda; Grzejszczak, Slawomir Tetrahedron Letters, 1984 , vol. 25, # 23 p. 2489 - 2492
  • Route2
    • 6-Nitroheptan-3-one|CS-0152645
      83188-08-3
    • ~55%
    • Heptane-2,5-dione|CS-0211119
      1703-51-1

    References

    • Ballini, Roberto; Bosica, Giovanna; Fiorini, Dennis; Petrini, Marino Tetrahedron Letters, 2002 , vol. 43, # 30 p. 5233 - 5235
  • Route3
    • null|null
      36678-43-0
    • ~44%
    • Heptane-2,5-dione|CS-0211119
      1703-51-1

    References

    • Nagashima, Hideo; Sakai, Kiyomi; Tsuji, Jiro Chemistry Letters, 1982 , p. 859 - 860

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   34.14
  • LogP   1.3347
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   4

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