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CS-W001157 4
Total: USD 88.00

7-Coumaryl triflate

  • CAS No. 108530-10-5

  • Cat. No. CS-0065167
  • Purity≥98%
  • MDL No.MFCD18382236

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

7-Coumaryl triflate|CS-0065167

Structure of 108530-10-5

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General Information

  • CAS No. 108530-10-5
  • Cat. No. CS-0065167
  • Purity ≥98%
  • MDL No. MFCD18382236
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₅F₃O₅S
  • Molecular Weight 294.20
  • Synonym(s) None
  • SMILES O=C1OC=2C=C(OS(=O)(=O)C(F)(F)F)C=CC2C=C1

Synthesis

  • Route1
    • In-stock
      Umbelliferone|CS-D1186
      93-35-6
    • null|null
      358-23-6
    • ~97%
    • In-stock
      7-Coumaryl triflate|CS-0065167
      108530-10-5

    References

    • PTC THERAPEUTICS, INC.; F. HOFFMANN-LA ROCHE AG; WOLL, Matthew G.; CHEN, Guangming; CHOI, Soongyu; DAKKA, Amal; HUANG, Song; KARP, Gary Mitchell; LEE, Chang-Sun; LI, Chunshi; NARASIMHAN, Jana; NARYSHKIN, Nikolai; PAUSHKIN, Sergey; QI, Hongyan; TURPOFF, Anthony A.; WEETALL, Marla L.; WELCH, Ellen; YANG, Tianle; ZHANG, Nanjing; ZHANG, Xiaoyan; ZHAO, Xin; PINARD, Emmanuel; RATNI, Hasane Patent: WO2013/101974 A1, 2013 ; Location in patent: Paragraph 00724; 00725 ;
  • Route2
    • In-stock
      Umbelliferone|CS-D1186
      93-35-6
    • null|null
      421-83-0
    • ~74%
    • In-stock
      7-Coumaryl triflate|CS-0065167
      108530-10-5

    References

    • Chtchigrovsky, Melanie; Primo, Ana; Gonzalez, Philippe; Molvinger, Karine; Robitzer, Mike; Quignard, Francoise; Taran, Frederic Angewandte Chemie - International Edition, 2009 , vol. 48, # 32 p. 5916 - 5920
  • Route3

    References

    • Starcevic, Stefan; Brozic, Petra; Turk, Samo; Cesar, Jozko; Lanisnik Rizner, Tea; Gobec, Stanislav Journal of Medicinal Chemistry, 2011 , vol. 54, # 1 p. 248 - 261

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-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   73.58
  • LogP   2.0214
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   2

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