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CS-W001157 4
Total: USD 88.00

4-Ethoxy-3-fluorobenzaldehyde

  • CAS No. 452-00-6

  • Cat. No. CS-0195223
  • Molecule weight168.16
  • Purity98+%
  • MDL No.None

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

4-Ethoxy-3-fluorobenzaldehyde|CS-0195223

Structure of 452-00-6

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General Information

  • CAS No. 452-00-6
  • Cat. No. CS-0195223
  • Purity 98+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉FO₂
  • Molecular Weight 168.16
  • Synonym(s) 3-Fluoro-4-ethoxybenzaldehyde
  • SMILES CCOC1=C(C=C(C=C1)C=O)F

Synthesis

  • Route1

    References

    • ASTRAZENECA AB Patent: WO2008/136756 A1, 2008 ; Location in patent: Page/Page column 124 ; WO 2008/136756 A1
  • Route2
    • null|null
      5749-33-7
    • ~%
    • 4-Ethoxy-3-fluorobenzaldehyde|CS-0195223
      452-00-6

    References

    • Maziere,B.; Dat-Xuong,N. Chimica Therapeutica, 1968 , vol. 3, p. 1 - 9
  • Route3

    References

    • Schiemann; Winkelmueller Journal fuer Praktische Chemie (Leipzig), 1932 , vol. <2> 135, p. 101,113

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.0369
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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