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CS-W001157 4
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Ethyl 2-fluoro-3-methylbut-2-enoate

  • CAS No. 685-89-2

  • Cat. No. CS-0536399
  • Purity≥98%
  • MDL No.None

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

Ethyl 2-fluoro-3-methylbut-2-enoate|CS-0536399

Structure of 685-89-2

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General Information

  • CAS No. 685-89-2
  • Cat. No. CS-0536399
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₁FO₂
  • Molecular Weight 146.16
  • Synonym(s) METHYL-2-BROMO-6-CHLOROBENZOATE
  • SMILES CCOC(=O)C(=C(C)C)F

Synthesis

  • Route1
    • null|null
      67-64-1
    • ~63%
    • Ethyl 2-fluoro-3-methylbut-2-enoate|CS-0536399
      685-89-2

    References

    • Chen, Li; Ding, Qingjie; Liu, Jin-Jun; Yang, Song; Zhang, Zhuming Patent: US2007/213341 A1, 2007 ; Location in patent: Page/Page column 89-90 ;
  • Route2

    References

    • Machleidt,H.; Wessendorf,R. Justus Liebigs Annalen der Chemie, 1964 , vol. 674, p. 1 - 10
  • Route3
    • null|null
      1597-39-3
    • null|null
      141-52-6
    • ~%
    • Ethyl 2-fluoro-3-methylbut-2-enoate|CS-0536399
      685-89-2

    References

    • Sterlin et al. Khimicheskaya Nauka i Promyshlennost, 1958 , vol. 3, p. 540 Chem.Abstr., 1959 , p. 4195

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   26.3
  • LogP   1.8129
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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