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CS-W001157 4
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4-Chlorobutanoic acid

  • CAS No. 627-00-9

  • Cat. No. CS-W013545
  • Molecule weight122.55
  • Purity≥95%
  • MDL No.MFCD00002818

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

4-Chlorobutanoic acid|CS-W013545

Structure of 627-00-9

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General Information

  • CAS No. 627-00-9
  • Cat. No. CS-W013545
  • Purity ≥95%
  • MDL No. MFCD00002818
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₇ClO₂
  • Molecular Weight 122.55
  • Synonym(s) 4-Chloro-n-butyric acid
  • SMILES O=C(O)CCCCl

Application

4-Chlorobutanoic acid serves as a versatile building block in synthetic organic chemistry, enabling efficient access to γ-chloro carbonyl compounds and heterocyclic scaffolds. Its well-established reactivity facilitates nucleophilic substitution, ring-closing reactions, and functional group interconversions under standard conditions. The molecule exhibits favorable bench stability and compatibility with common protecting groups, making it suitable for multi-step syntheses in medicinal chemistry and process development workflows.

Synthesis

  • Route1
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      96-48-0
    • ~81%
    • In-stock
      4-Chlorobutanoic acid|CS-W013545
      627-00-9

    References

    • Athar, Taimur Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1998 , vol. 37, # 10 p. 1037 - 1038
  • Route2

    References

    • Chemat, Farid; Poux, Martine; Berlan, Jacques Journal of the Chemical Society. Perkin Transactions 2, 1996 , vol. 8, p. 1781 - 1784
  • Route3
    • null|null
      3153-36-4
    • ~%
    • In-stock
      4-Chlorobutanoic acid|CS-W013545
      627-00-9

    References

    • Journal of the American Chemical Society, , vol. 63, p. 2490

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3265
Class : 8
Packing Group : Ⅱ
Hazard Statements : H302-H314
Precautionary Statements : P260-P264-P270-P280-P301+P330+P331-P304+P340-P330-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   1.09
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   3

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