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CS-W001157 4
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3-(Naphthalen-1-yl)propanoic acid

  • CAS No. 3243-42-3

  • Cat. No. CS-0072735
  • Molecule weightNone
  • Purity≥96%
  • MDL No.MFCD00033058

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

3-(Naphthalen-1-yl)propanoic acid|CS-0072735

Structure of 3243-42-3

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General Information

  • CAS No. 3243-42-3
  • Cat. No. CS-0072735
  • Purity ≥96%
  • MDL No. MFCD00033058
  • Storage Store at room temperature, keep dry and cool
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₂O₂
  • Molecular Weight None
  • Synonym(s) 3-(1-NAPHTHYL)-PROPIONIC ACID
  • SMILES O=C(O)CCC1=CC=CC2=CC=CC=C12

Description

This naphthalene-containing carboxylic acid integrates a rigid aromatic core with a flexible propionic linker, enabling precise spatial positioning in molecular architectures. The extended π-system enhances conjugation and influences electronic properties, while the terminal carboxyl group offers versatile coupling potential for peptide synthesis, polymer functionalization, or bioconjugation under standard conditions.

Application

3-(Naphthalen-1-yl)propanoic acid serves as a versatile building block for pharmaceutical and agrochemical synthesis, enabling the construction of bioactive heterocycles and extended π-systems. Its benzylic carboxylic acid functionality facilitates straightforward derivatization via esterification, amidation, or decarboxylation. The molecule exhibits good bench stability, solubility in common organic solvents, and compatibility with standard coupling reactions, making it well-suited for iterative synthesis workflows in medicinal chemistry and process development.

Synthesis

  • Route1

    References

    • Manitto, Paolo; Monti, Diego; Zanzola, Simona; Speranza, Giovanna Journal of Organic Chemistry, 1997 , vol. 62, # 19 p. 6658 - 6665
  • Route2
    • diethyl 2-(naphthalen-1-ylmethyl)malonate|CS-0680897
      2107-84-8
    • ~79%
    • In-stock
      3-(Naphthalen-1-yl)propanoic acid|CS-0072735
      3243-42-3

    References

    • Yan, Hao; Li, Zhi-Fen; Guo, Zhi-Fo; Lu, Zhong-Lin; Wang, Feng; Wu, Li-Zhu Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 2 p. 801 - 808
  • Route3
    • null|null
      313058-72-9
    • ~80%
    • In-stock
      3-(Naphthalen-1-yl)propanoic acid|CS-0072735
      3243-42-3

    References

    • Orita, Akihiro; Yaruva, Jayamma; Otera, Junzo Angewandte Chemie - International Edition, 1999 , vol. 38, # 15 p. 2267 - 2270

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H303-H315-H318-H335-H401
Precautionary Statements : P260-P264-P271-P273-P280-P302+P352-P304+P340-P305+P351+P338-P310-P312-P332+P313-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.857
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   3

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