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CS-W001157 4
Total: USD 88.00

Hex-3-yne-2,5-diol

  • CAS No. 3031-66-1

  • Cat. No. CS-0077161
  • Purity≥98%
  • MDL No.MFCD00004542

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

Hex-3-yne-2,5-diol|CS-0077161

Structure of 3031-66-1

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General Information

  • CAS No. 3031-66-1
  • Cat. No. CS-0077161
  • Purity ≥98%
  • MDL No. MFCD00004542
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₀O₂
  • Molecular Weight 114.14
  • Synonym(s) 3-hexyne-2,5-diol, mixture of (+
  • SMILES CC(O)C#CC(O)C

Synthesis

  • Route1
    • null|null
      75-07-0
    • null|null
      74-86-2
    • ~%
    • Hex-3-yne-2,5-diol|CS-0077161
      3031-66-1
    • null|null
      2028-63-9

    References

    • Acetylene Chemistry <New York 1949>S.102 DE726714 , ; DRP/DRBP Org.Chem. Justus Liebigs Annalen der Chemie, , vol. 596, p. 65
  • Route2
    • null|null
      9004-34-6
    • ~%
    • Hex-3-yne-2,5-diol|CS-0077161
      3031-66-1

    References

    • Environmental Science and Technology, , vol. 33, # 15 p. 2584 - 2592
  • Route3
    • null|null
      31556-90-8
    • ~%
    • Hex-3-yne-2,5-diol|CS-0077161
      3031-66-1

    References

    • Synthetic Communications, , vol. 20, # 12 p. 1877 - 1884

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   40.46
  • LogP   -0.2486
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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