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CS-W001157 4
Total: USD 88.00

2-(4-Hydroxyphenyl)-2-methylpropanoic acid

  • CAS No. 29913-51-7

  • Cat. No. CS-0042615
  • Purity≥97%
  • MDL No.MFCD00995712

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

2-(4-Hydroxyphenyl)-2-methylpropanoic acid|CS-0042615

Structure of 29913-51-7

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General Information

  • CAS No. 29913-51-7
  • Cat. No. CS-0042615
  • Purity ≥97%
  • MDL No. MFCD00995712
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂O₃
  • Molecular Weight 180.20
  • Synonym(s) 4-hydroxy-.alpha.,.alpha.-dimethyl-Benzeneacetic acid
  • SMILES CC(C)(C1=CC=C(O)C=C1)C(O)=O

Synthesis

  • Route1
    • 2-(4-Methoxy-phenyl)-2-methyl-propionic acid methyl ester|CS-0208704
      6274-50-6
    • ~79%
    • In-stock
      2-(4-Hydroxyphenyl)-2-methylpropanoic acid|CS-0042615
      29913-51-7

    References

    • TEMPERO PHARMACEUTICALS, INC.; BALOGLU, Erkan; GHOSH, Shomir; LOBERA, Mercedes; SCHMIDT, Darby, R. Patent: WO2013/19635 A1, 2013 ; Location in patent: Page/Page column 55 ; WO 2013/019635 A1
  • Route2

    References

    • Palkowitz, Alan D.; Steinberg, Mitchell I.; Thrasher, K. Jeff; Reel, Jon K.; Hauser, Kenneth L.; et al. Journal of Medicinal Chemistry, 1994 , vol. 37, # 26 p. 4508 - 4521
  • Route3
    • null|null
      108-95-2
    • ~%
    • In-stock
      2-(4-Hydroxyphenyl)-2-methylpropanoic acid|CS-0042615
      29913-51-7

    References

    • Ashland Oil, Inc. Patent: US4827845 A1, 1989 ;

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   1.7544
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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