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CS-W001157 4
Total: USD 88.00

Dimethyl bicyclo[2.1.1]hexane-1,4-dicarboxylate

  • CAS No. 42145-38-0

  • Cat. No. CS-0058472
  • Purity≥95%
  • MDL No.MFCD22371985

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

Dimethyl bicyclo[2.1.1]hexane-1,4-dicarboxylate|CS-0058472

Structure of 42145-38-0

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General Information

  • CAS No. 42145-38-0
  • Cat. No. CS-0058472
  • Purity ≥95%
  • MDL No. MFCD22371985
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₄O₄
  • Molecular Weight 198.22
  • Synonym(s) Dimethylbicyclo[2.1.1]hexane-1,4-dicarboxylate
  • SMILES COC(C12CC(C(OC)=O)(C2)CC1)=O

Synthesis

  • Route1
    • dimethyl (1R,3S)-cyclopentane-1,3-dicarboxylate|CS-0038873
      39590-04-0
    • ~%
    • In-stock
      Dimethyl bicyclo[2.1.1]hexane-1,4-dicarboxylate|CS-0058472
      42145-38-0

    References

    • Warner, Philip M.; Chen, Bing-Lin; Wada, Eiji Journal of Organic Chemistry, 1981 , vol. 46, # 23 p. 4795 - 4797
  • Route2
    • null|null
      79028-25-4
    • ~%
    • In-stock
      Dimethyl bicyclo[2.1.1]hexane-1,4-dicarboxylate|CS-0058472
      42145-38-0

    References

    • Warner, Philip M.; Chen, Bing-Lin; Wada, Eiji Journal of Organic Chemistry, 1981 , vol. 46, # 23 p. 4795 - 4797

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.6
  • LogP   0.8928
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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