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CS-W001157 4
Total: USD 88.00

3-N-Propylphenol

  • CAS No. 621-27-2

  • Cat. No. CS-W016527
  • Purity≥95%
  • MDL No.MFCD01632130

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

3-N-Propylphenol|CS-W016527

Structure of 621-27-2

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General Information

  • CAS No. 621-27-2
  • Cat. No. CS-W016527
  • Purity ≥95%
  • MDL No. MFCD01632130
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂O
  • Molecular Weight 136.19
  • Synonym(s) None
  • SMILES OC1=CC=CC(CCC)=C1

Description

3-N-Propylphenol features a propyl group attached to the nitrogen of a phenolic scaffold, delivering enhanced lipophilicity and stability. This structural modification improves membrane permeability while maintaining phenolic reactivity, making it valuable for synthesizing bioactive intermediates and functional materials under standard conditions.

Application

3-N-Propylphenol serves as a versatile phenolic building block for the synthesis of functionalized aromatics and heterocycles. Its propylamino group enables facile derivatization via alkylation, acylation, or coupling reactions, while the phenolic hydroxyl supports efficient protection and metal-catalyzed transformations. The compound exhibits good bench stability and compatibility with standard purification methods, making it well-suited for iterative synthetic sequences in medicinal chemistry and materials development.

Synthesis

  • Route1
    • Metaraminol Impurity 11|CS-1004196
      55789-02-1
    • ~94%
    • In-stock
      3-N-Propylphenol|CS-W016527
      621-27-2

    References

    • Ujvary, Istvan; Mikite, Gyula Organic Process Research and Development, 2003 , vol. 7, # 4 p. 585 - 587
  • Route2
    • null|null
      54509-73-8
    • null|null
      108-39-4
    • ~48%
    • In-stock
      3-N-Propylphenol|CS-W016527
      621-27-2

    References

    • Steele, Barry R.; Villalonga-Barber, Carolina; Micha-Screttas, Maria; Screttas, Constantinos G. Tetrahedron Letters, 2006 , vol. 47, # 13 p. 2093 - 2097
  • Route3
    • null|null
      54509-73-8
    • null|null
      108-39-4
    • ~44%
    • In-stock
      3-N-Propylphenol|CS-W016527
      621-27-2
    • 3-(Pentan-3-yl)phenol|CS-0814649
      97218-43-4

    References

    • Tetrahedron Letters, , vol. 47, # 13 p. 2093 - 2097

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3145
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P304+P340-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.3447
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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