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CS-W001157 4
Total: USD 88.00

3,5-Diethynylbenzoic acid

  • CAS No. 883106-26-1

  • Cat. No. CS-0158571
  • Molecule weight170.16
  • Purity≥95%
  • MDL No.MFCD06658429

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

3,5-Diethynylbenzoic acid|CS-0158571

Structure of 883106-26-1

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General Information

  • CAS No. 883106-26-1
  • Cat. No. CS-0158571
  • Purity ≥95%
  • MDL No. MFCD06658429
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₆O₂
  • Molecular Weight 170.16
  • Synonym(s) 3,5-DIETHYNYL-BENZOIC ACID
  • SMILES C#CC1=CC(=CC(=C1)C(=O)O)C#C

Synthesis

  • Route1
    • null|null
      437707-58-9
    • ~86%
    • In-stock
      3,5-Diethynylbenzoic acid|CS-0158571
      883106-26-1

    References

    • Tobe, Yoshito; Utsumi, Naoto; Kawabata, Kazuya; Nagano, Atsushi; Adachi, Kiyomi; Araki, Shunji; Sonoda, Motohiro; Hirose, Keiji; Naemura, Koichiro Journal of the American Chemical Society, 2002 , vol. 124, # 19 p. 5350 - 5364
  • Route2
    • null|null
      437707-60-3
    • ~50%
    • In-stock
      3,5-Diethynylbenzoic acid|CS-0158571
      883106-26-1

    References

    • Matsuda, Kenji; Stone, Matthew T.; Moore, Jeffrey S. Journal of the American Chemical Society, 2002 , vol. 124, # 40 p. 11836 - 11837
  • Route3
    • Ethyl 3,5-dibromobenzoate|CS-0669928
      67973-33-5
    • ~%
    • In-stock
      3,5-Diethynylbenzoic acid|CS-0158571
      883106-26-1

    References

    • Matsuda, Kenji; Stone, Matthew T.; Moore, Jeffrey S. Journal of the American Chemical Society, 2002 , vol. 124, # 40 p. 11836 - 11837

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   37.3
  • LogP   1.3474
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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