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CS-W001157 4
Total: USD 88.00

Dimethyl bicyclo[3.2.1]Octane-1,5-dicarboxylate

  • CAS No. 106004-11-9

  • Cat. No. CS-0440335
  • Molecule weight226.27
  • Purity≥98%
  • MDL No.None

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

Dimethyl bicyclo[3.2.1]Octane-1,5-dicarboxylate|CS-0440335

Structure of 106004-11-9

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General Information

  • CAS No. 106004-11-9
  • Cat. No. CS-0440335
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₈O₄
  • Molecular Weight 226.27
  • Synonym(s) octane-1,5-dicarboxylate, diMethyl bicyclo[3.2.1]octane-1,5-dicarboxylate">diMethyl bicyclooctane-1,5-dicarboxylate, diMethyl bicyclo[3.2.1]octane-1,5-dicarboxylate
  • SMILES COC(=O)C12CCCC(CC1)(C2)C(=O)OC

Synthesis

  • Route1
    • null|null
      106004-10-8
    • ~%
    • Dimethyl bicyclo[3.2.1]Octane-1,5-dicarboxylate|CS-0440335
      106004-11-9

    References

    • H. LUNDBECK A/S; LI, Guiying; ZHOU, Hao; WEISS, Jesse; DOLLER, Dario; FORD, James Patent: WO2012/88365 A1, 2012 ; Location in patent: Page/Page column 24-25 ; WO 2012/088365 A1
  • Route2

    References

    • Della, Ernest W.; Tsanaktsidis, John Australian Journal of Chemistry, 1985 , vol. 38, # 11 p. 1705 - 1718
  • Route3

    References

    • H. LUNDBECK A/S; LI, Guiying; ZHOU, Hao; WEISS, Jesse; DOLLER, Dario; FORD, James Patent: WO2012/88365 A1, 2012 ; WO 2012/088365 A1

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   52.6
  • LogP   1.673
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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