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CS-W001157 4
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3-Methylbicyclo[1.1.1]pentane-1-carboxylic acid

  • CAS No. 65862-01-3

  • Cat. No. CS-0051246
  • Purity≥96%
  • MDL No.MFCD19228632

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

3-Methylbicyclo[1.1.1]pentane-1-carboxylic acid|CS-0051246

Structure of 65862-01-3

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General Information

  • CAS No. 65862-01-3
  • Cat. No. CS-0051246
  • Purity ≥96%
  • MDL No. MFCD19228632
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₀O₂
  • Molecular Weight None
  • Synonym(s) methyl 3-methylbicyclo[1.1.1]pentance-1-carboxylate
  • SMILES CC12CC(C1)(C2)C(O)=O

Synthesis

  • Route1
    • null|null
      124-38-9
    • 1-Iodo-3-methylbicyclo[1.1.1]pentane|CS-0056912
      136399-10-5
    • ~50%
    • In-stock
      3-Methylbicyclo[1.1.1]pentane-1-carboxylic acid|CS-0051246
      65862-01-3

    References

    • SIGNAL PHARMACEUTICALS, LLC; BENNETT, Brydon, L.; ELSNER, Jan; ERDMAN, Paul; HILGRAF, Robert; LEBRUN, Laurie, Ann; MCCARRICK, Meg; MOGHADDAM, Mehran, F.; NAGY, Mark, A.; NORRIS, Stephen; PAISNER, David, A.; SLOSS, Marianne; ROMANOW, William, J.; SATOH, Yoshitaka; TIKHE, Jayashree; YOON, Won, Hyung; DELGADO, Mercedes Patent: WO2012/145569 A1, 2012 ; Location in patent: Page/Page column 184; 185 ;
  • Route2
    • null|null
      138732-35-1
    • ~97%
    • In-stock
      3-Methylbicyclo[1.1.1]pentane-1-carboxylic acid|CS-0051246
      65862-01-3

    References

    • Della, Ernest W.; Taylor, Dennis K. Journal of Organic Chemistry, 1994 , vol. 59, # 11 p. 2986 - 2996
  • Route3
    • null|null
      30494-14-5
    • ~%
    • In-stock
      3-Methylbicyclo[1.1.1]pentane-1-carboxylic acid|CS-0051246
      65862-01-3

    References

    • Applequist,D.E.; Wheeler,J.W. Tetrahedron Letters, 1977 , p. 3411 - 3412

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   1.2612
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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