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CS-W001157 4
Total: USD 88.00

3-(3-Chloro-4-fluorophenyl)propanoic acid

  • CAS No. 881190-93-8

  • Cat. No. CS-0070691
  • Molecule weight202.61
  • Purity≥97%
  • MDL No.MFCD04116056

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

3-(3-Chloro-4-fluorophenyl)propanoic acid|CS-0070691

Structure of 881190-93-8

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General Information

  • CAS No. 881190-93-8
  • Cat. No. CS-0070691
  • Purity ≥97%
  • MDL No. MFCD04116056
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈ClFO₂
  • Molecular Weight 202.61
  • Synonym(s) 3-chloro-4-fluoroBenzenepropanoic acid
  • SMILES O=C(O)CCC1=CC(Cl)=C(F)C=C1

Synthesis

  • Route1

    References

    • Musso, David L.; Orr, G. Faye; Cochran, Felicia R.; Kelley, James L.; Selph, Jeffrey L.; Rigdon, Greg C.; Cooper, Barrett R.; Jones, Michael L. Journal of Medicinal Chemistry, 2003 , vol. 46, # 3 p. 409 - 416
  • Route2

    References

    • Musso, David L.; Orr, G. Faye; Cochran, Felicia R.; Kelley, James L.; Selph, Jeffrey L.; Rigdon, Greg C.; Cooper, Barrett R.; Jones, Michael L. Journal of Medicinal Chemistry, 2003 , vol. 46, # 3 p. 409 - 416

Safety Information

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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

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.4963
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   3

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