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CS-W001157 4
Total: USD 88.00

(E)-4-tert-butyl 1-ethyl 2-(4-fluorobenzylidene)succinate

  • CAS No. 157188-11-9

  • Cat. No. CS-M0967
  • Molecule weight308.34
  • Purity≥98%
  • MDL No.None

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

(E)-4-tert-butyl 1-ethyl 2-(4-fluorobenzylidene)succinate|CS-M0967

Structure of 157188-11-9

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General Information

  • CAS No. 157188-11-9
  • Cat. No. CS-M0967
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₂₁FO₄
  • Molecular Weight 308.34
  • Synonym(s) Butanedioic acid, [(4-fluorophenyl)methylene]-, 4-(1,1-dimethylethyl) 1-ethyl ester, (E)- (9CI)
  • SMILES O=C(OCC)/C(CC(OC(C)(C)C)=O)=C/C1=CC=C(F)C=C1

Synthesis

  • Route1
    • null|null
      5292-43-3
    • ~%
    • (E)-4-tert-butyl 1-ethyl 2-(4-fluorobenzylidene)succinate|CS-M0967
      157188-11-9

    References

    • Owton; Gallagher; Juan-Montesinos Synthetic Communications, 1993 , vol. 23, # 15 p. 2119 - 2125

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   3.504
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   5

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