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CS-W001157 4
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Pentane-1,5-diyl diacetate

  • CAS No. 6963-44-6

  • Cat. No. CS-0319552
  • Purity≥98%
  • MDL No.None

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

Pentane-1,5-diyl diacetate|CS-0319552

Structure of 6963-44-6

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General Information

  • CAS No. 6963-44-6
  • Cat. No. CS-0319552
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₆O₄
  • Molecular Weight 188.22
  • Synonym(s) Pentamethylene Diacetate
  • SMILES CC(=O)OCCCCCOC(=O)C

Synthesis

  • Route1

    References

    • Phukan, Prodeep Tetrahedron Letters, 2004 , vol. 45, # 24 p. 4785 - 4787
  • Route2
    • Cisatracurium Impurity 5|CS-1658268
      68750-23-2
    • null|null
      108-24-7
    • ~92%
    • Pentane-1,5-diyl diacetate|CS-0319552
      6963-44-6

    References

    • Rahmatpour, Ali Comptes Rendus Chimie, 2012 , vol. 15, # 11-12 p. 1048 - 1054
  • Route3

    References

    • Angewandte Chemie - International Edition, , vol. 50, # 21 p. 4888 - 4892

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H317-H319
Precautionary Statements : P261-P264-P272-P280-P302+P352-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.6
  • LogP   1.2829
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   6

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