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CS-W001157 4
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3-Phenoxypropan-1-ol

  • CAS No. 6180-61-6

  • Cat. No. CS-0128791
  • Purity≥97%
  • MDL No.MFCD00039549

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

3-Phenoxypropan-1-ol|CS-0128791

Structure of 6180-61-6

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General Information

  • CAS No. 6180-61-6
  • Cat. No. CS-0128791
  • Purity ≥97%
  • MDL No. MFCD00039549
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂O₂
  • Molecular Weight None
  • Synonym(s) 1-Propanol, 3-phenoxy-
  • SMILES OCCCOC1=CC=CC=C1

Description

3-Phenoxypropan-1-ol features a hydroxyl-bearing aliphatic chain linked to a phenyl ring, enabling versatile integration into bioactive molecules. This structure combines polarity with aromatic stability, supporting use in pharmaceutical intermediates and agrochemical synthesis under standard conditions.

Application

3-Phenoxypropan-1-ol serves as a versatile building block in synthetic organic chemistry, enabling efficient construction of bioactive scaffolds and pharmaceutical intermediates. Its bifunctional nature—combining a primary alcohol and an ether linkage—facilitates orthogonal transformations, including derivatization, protection, and coupling reactions. The compound exhibits good bench stability and ease of purification, making it well-suited for iterative synthesis workflows in medicinal chemistry and process development.

Synthesis

  • Route1
    • null|null
      627-30-5
    • null|null
      108-95-2
    • ~77%
    • In-stock
      3-Phenoxypropan-1-ol|CS-0128791
      6180-61-6

    References

    • Peprah, Kwakye; Zhu, Xue Y.; Eyunni, Suresh V.K.; Setola, Vincent; Roth, Bryan L.; Ablordeppey, Seth Y. Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 3 p. 1291 - 1297
  • Route2

    References

    • Romeiro, Luiz A.S.; Da Silva Ferreira, Marcos; Da Silva, Leandro L.; Castro, Helena C.; Miranda, Ana L.P.; Silva, Claudia L.M.; Noel, Franois; Nascimento, Jessica B.; Araujo, Claudia V.; Tibirica, Eduardo; Barreiro, Eliezer J.; Fraga, Carlos A.M. European Journal of Medicinal Chemistry, 2011 , vol. 46, # 7 p. 3000 - 3012
  • Route3
    • null|null
      1141498-11-4
    • ~77%
    • In-stock
      3-Phenoxypropan-1-ol|CS-0128791
      6180-61-6

    References

    • Murphy, John A.; Schoenebeck, Franziska; Findlay, Neil J.; Thomson, Douglas W.; Zhou, Sheng-ze; Garnier, Jean Journal of the American Chemical Society, 2009 , vol. 131, p. 6475 - 6479

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

Quality Control

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Computational Chemistry Data

  • TPSA   29.46
  • LogP   1.4478
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   4

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