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CS-W001157 4
Total: USD 88.00

4-(Hydroxymethyl)bicyclo[2.2.2]octane-1-carboxylic acid

  • CAS No. 828-52-4

  • Cat. No. CS-0042845
  • Purity≥97%
  • MDL No.MFCD09835291

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

4-(Hydroxymethyl)bicyclo[2.2.2]octane-1-carboxylic acid|CS-0042845

Structure of 828-52-4

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General Information

  • CAS No. 828-52-4
  • Cat. No. CS-0042845
  • Purity ≥97%
  • MDL No. MFCD09835291
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₆O₃
  • Molecular Weight 184.23
  • Synonym(s) 4-HYDROXYMETHYL-BICYCLO[2.2.2]OCTANE-1-CARBOXYLIC ACID
  • SMILES OCC12CCC(CC1)(CC2)C(O)=O

Synthesis

  • Route1

    References

    • Biogen, Inc. Patent: US6649600 B1, 2003 ; Location in patent: Page/Page column 58 ; US 6649600 B1
  • Route2
    • null|null
      843-52-7
    • ~%
    • 4-(Hydroxymethyl)bicyclo[2.2.2]octane-1-carboxylic acid|CS-0042845
      828-52-4

    References

    • Holtz,H.D.; Stock,L.M. Journal of the American Chemical Society, 1964 , vol. 86, p. 5183 - 5188
  • Route3
    • null|null
      830-28-4
    • ~%
    • 4-(Hydroxymethyl)bicyclo[2.2.2]octane-1-carboxylic acid|CS-0042845
      828-52-4

    References

    • Holtz,H.D.; Stock,L.M. Journal of the American Chemical Society, 1964 , vol. 86, p. 5183 - 5188

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   1.4039
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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