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CS-W001157 4
Total: USD 88.00

3-(Cyclopentyloxy)-4-methoxybenzaldehyde

  • CAS No. 67387-76-2

  • Cat. No. CS-B1511
  • Purity≥98%
  • MDL No.MFCD00673136

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

3-(Cyclopentyloxy)-4-methoxybenzaldehyde|CS-B1511

Structure of 67387-76-2

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General Information

  • CAS No. 67387-76-2
  • Cat. No. CS-B1511
  • Purity ≥98%
  • MDL No. MFCD00673136
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₆O₃
  • Molecular Weight 220.26
  • Synonym(s) Benzaldehyde, 3-(cyclopentyloxy)-4-methoxy-
  • SMILES O=CC1=CC=C(OC)C(OC2CCCC2)=C1

Description

3-(Cyclopentyloxy)-4-methoxybenzaldehyde features a cyclopentyloxy group that enhances lipophilicity and metabolic stability, while the para-methoxy substituent modulates electron density. This aldehyde integrates readily into synthetic routes requiring aromatic scaffolds with tunable solubility and reactivity under standard conditions.

Application

3-(Cyclopentyloxy)-4-methoxybenzaldehyde serves as a versatile building block in medicinal chemistry, enabling the synthesis of bioactive heterocycles and aromatic scaffolds. Its aldehyde functionality facilitates efficient coupling reactions, while the cyclopentyloxy and methoxy groups provide steric and electronic modulation. The compound exhibits good bench stability and is compatible with standard purification methods, making it well-suited for iterative synthetic workflows in API development.

Synthesis

  • Route1
    • In-stock
      Isovanillin|CS-W009023
      621-59-0
    • null|null
      137-43-9
    • ~10%
    • In-stock
      3-(Cyclopentyloxy)-4-methoxybenzaldehyde|CS-B1511
      67387-76-2

    References

    • Brackeen, Marcus F.; Cowan, David J.; Stafford, Jeffrey A.; Schoenen, Frank J.; Veal, James M.; et al. Journal of Medicinal Chemistry, 1995 , vol. 38, # 24 p. 4848 - 4854
  • Route2
    • In-stock
      Isovanillin|CS-W009023
      621-59-0
    • null|null
      930-28-9
    • ~97%
    • In-stock
      3-(Cyclopentyloxy)-4-methoxybenzaldehyde|CS-B1511
      67387-76-2

    References

    • SmithKline Beecham Corporation Patent: US6337408 B1, 2002 ; Location in patent: Example 1 ;
  • Route3
    • null|null
      137-43-9
    • Vanillin, ≥97%|CS-1268660
      121-33-5
    • ~78%
    • In-stock
      3-(Cyclopentyloxy)-4-methoxybenzaldehyde|CS-B1511
      67387-76-2

    References

    • Kim, Euikyung; Chun, Hyung-Ok; Jung, Sung-Hak; Kim, Jong Hoon; Lee, Jae-Mok; Suh, Byung-Chul; Xiang, Myung Xik; Rhee, Chung K. Bioorganic and Medicinal Chemistry Letters, 2003 , vol. 13, # 14 p. 2355 - 2358

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   35.53
  • LogP   2.8291
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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