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CS-W001157 4
Total: USD 88.00

1,4-Dimethyl but-2-ynedioate

  • CAS No. 762-42-5

  • Cat. No. CS-D0471
  • Molecule weight142.11
  • Purity≥95%
  • MDL No.MFCD00008456

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

1,4-Dimethyl but-2-ynedioate|CS-D0471

Structure of 762-42-5

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General Information

  • CAS No. 762-42-5
  • Cat. No. CS-D0471
  • Purity ≥95%
  • MDL No. MFCD00008456
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₆O₄
  • Molecular Weight 142.11
  • Synonym(s) Dimethylaceylene dicarboxylate
  • SMILES O=C(C#CC(OC)=O)OC

Description

Thalidomide 4'-ether-alkylC3-acid contains a cereblon ligand, an alkylC3, and a terminal amine. This product is ready for conjugation to target proteins for PROTAC R&D.

Synthesis

  • Route1
    • null|null
      1114-20-1
    • ~92%
    • In-stock
      1,4-Dimethyl but-2-ynedioate|CS-D0471
      762-42-5

    References

    • Charlton, James L.; Chee, Gaiklean; McColeman, Heather Canadian Journal of Chemistry, 1995 , vol. 73, # 9 p. 1454 - 1462
  • Route2
    • null|null
      64995-84-2
    • ~57%
    • In-stock
      1,4-Dimethyl but-2-ynedioate|CS-D0471
      762-42-5
    • In-stock
      Triphenylphosphine oxide|CS-Z0018
      791-28-6

    References

    • Aitken; Herion; Janosi; Raut; Seth; Shannon; Smith Tetrahedron Letters, 1993 , vol. 34, # 35 p. 5621 - 5622
  • Route3
    • null|null
      68827-52-1
    • null|null
      67-56-1
    • ~0%
    • In-stock
      1,4-Dimethyl but-2-ynedioate|CS-D0471
      762-42-5
    • 5-Phenyl-1H-1,2,4-triazole-3-thiol|CS-0309170
      3414-94-6

    References

    • Britsun; Esipenko; Chernega; Lozinskii Russian Journal of Organic Chemistry, 2005 , vol. 41, # 1 p. 108 - 113

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3265
Class : 8
Packing Group : Ⅱ
Hazard Statements : H227-H302-H314
Precautionary Statements : P210-P260-P264-P270-P280-P301+P330+P331-P304+P340-P330-P363-P370+P378-P403-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.6
  • LogP   -0.6642
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   0

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