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CS-W001157 4
Total: USD 88.00

4-Phenylbutan-1-ol

  • CAS No. 3360-41-6

  • Cat. No. CS-W018137
  • Purity≥98%
  • MDL No.MFCD00002971

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

4-Phenylbutan-1-ol|CS-W018137

Structure of 3360-41-6

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General Information

  • CAS No. 3360-41-6
  • Cat. No. CS-W018137
  • Purity ≥98%
  • MDL No. MFCD00002971
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₄O
  • Molecular Weight None
  • Synonym(s) 4-Phenylbutyl Alcohol
  • SMILES C1=C(CCCCO)C=CC=C1

Description

4-Phenyl-1-butanol is oxidized by ceric ammonium nitrate in acetonitrile to afford 2-phenyltetrahydrofuran. It undergoes cyclization in presence of phosphoric acid at high temperature to yield tetralin.4-Phenyl-1-butanol was used in synthesis of NK105, a paclitaxel-incorporating micellar nanoparticle formulation.

Synthesis

  • Route1

    References

    • US2010/9950 A1, ; Page/Page column 20 ; US 20100009950 A1
  • Route2

    References

    • Journal of the American Chemical Society, , vol. 134, # 42 p. 17376 - 17379,4 Journal of the American Chemical Society, , vol. 134, # 42 p. 17376 - 17379
  • Route3

    References

    • Russian Journal of Organic Chemistry, , vol. 40, # 6 p. 759 - 762

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P260-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.0016
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   4

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