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CS-W001157 4
Total: USD 88.00

Oct-1-yn-3-ol

  • CAS No. 818-72-4

  • Cat. No. CS-W011154
  • Molecule weight126.20
  • Purity≥98%
  • MDL No.MFCD00004588

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

Oct-1-yn-3-ol|CS-W011154

Structure of 818-72-4

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General Information

  • CAS No. 818-72-4
  • Cat. No. CS-W011154
  • Purity ≥98%
  • MDL No. MFCD00004588
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄O
  • Molecular Weight 126.20
  • Synonym(s) Xin acetylene-3-ol
  • SMILES C#CC(O)CCCCC

Description

1-Octyn-3-ol is a racemic intermediate formed during the synthesis of enantiomerically pure secondary alcohols with sterically similar substituents.1-Octyn-3-ol was used in the synthesis of synthetic tricolorin A, a novel tetrasaccharide macrolactone that is a natural herbicide.

Synthesis

  • Route1
    • null|null
      834-16-2
    • ~93%
    • In-stock
      Oct-1-yn-3-ol|CS-W011154
      818-72-4

    References

    • Tetrahedron Letters, , vol. 40, # 7 p. 1323 - 1326
  • Route2
    • null|null
      66-25-1
    • null|null
      4301-14-8
    • ~%
    • In-stock
      Oct-1-yn-3-ol|CS-W011154
      818-72-4

    References

    • Journal of Medicinal Chemistry, , vol. 8, p. 41 - 45
  • Route3
    • null|null
      66-25-1
    • null|null
      74-86-2
    • ~68%
    • In-stock
      Oct-1-yn-3-ol|CS-W011154
      818-72-4

    References

    • Synthesis, , # 9 p. 1381 - 1390

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS09
Signal Word : Warning
UN#: 3082
Class : 9
Packing Group : Ⅲ
Hazard Statements : H227-H302-H410
Precautionary Statements : P210-P264-P270-P273-P280-P330-P370+P378-P391-P403-P501

Quality Control

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   1.5608
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   4

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