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CS-W001157 4
Total: USD 88.00

2-(3-Chlorophenyl)ethanol

  • CAS No. 5182-44-5

  • Cat. No. CS-W001945
  • Purity≥98%
  • MDL No.MFCD00002892

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

2-(3-Chlorophenyl)ethanol|CS-W001945

Structure of 5182-44-5

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General Information

  • CAS No. 5182-44-5
  • Cat. No. CS-W001945
  • Purity ≥98%
  • MDL No. MFCD00002892
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉ClO
  • Molecular Weight 156.61
  • Synonym(s) 3-Chlorophenethyl Alcohol
  • SMILES ClC1=CC=CC(CCO)=C1

Description

2-(3-Chlorophenyl)ethanol is a bench-stable, moisture-tolerant aromatic alcohol featuring a chlorinated phenyl ring linked via an ethylene bridge. This structure enables direct incorporation into pharmaceutical intermediates and functional materials, where the hydroxyl group serves as a reactive handle for derivatization under standard conditions.

Application

2-(3-Chlorophenyl)ethanol serves as a versatile building block in medicinal chemistry, enabling the synthesis of pharmaceutically relevant arylalkanol derivatives. Its benzylic alcohol functionality facilitates straightforward functionalization—such as oxidation to aldehydes or carboxylic acids—and participates reliably in coupling reactions. The ortho-chloro substituent provides moderate electronic modulation and enhances metabolic stability, while the compound exhibits good bench stability and ease of purification, making it well-suited for scalable intermediate development.

Synthesis

  • Route1

    References

    • Lanni Jr., Thomas B.; Greene, Keri L.; Kolz, Christine N.; Para, Kimberly S.; Visnick, Melean; Mobley, James L.; Dudley, David T.; Baginski, Theodore J.; Liimatta, Marya B. Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 3 p. 756 - 760
  • Route2

    References

    • Tsuchiya, Yasunori; Uchimura, Hirofumi; Kobayashi, Kazuki; Nishiyama, Hisao Synlett, 2004 , # 12 p. 2099 - 2102
  • Route3

    References

    • Li, Le; Herzon, Seth B. Nature Chemistry, 2014 , vol. 6, # 1 p. 22 - 27

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   1.8748
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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