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(1-Methylcyclobutyl)methanol

  • CAS No. 38401-41-1

  • Cat. No. CS-0072446
  • Purity≥98%
  • MDL No.MFCD18072623

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

(1-Methylcyclobutyl)methanol|CS-0072446

Structure of 38401-41-1

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General Information

  • CAS No. 38401-41-1
  • Cat. No. CS-0072446
  • Purity ≥98%
  • MDL No. MFCD18072623
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₂O
  • Molecular Weight 100.16
  • Synonym(s) 1-Methyl-cyclobutanemethanol
  • SMILES OCC1(C)CCC1

Description

(1-Methylcyclobutyl)methanol features a rigid cyclobutane ring with a methyl substituent, delivering enhanced steric bulk and conformational stability. This structural motif enables selective reactivity in synthetic transformations, particularly in asymmetric synthesis and as a chiral auxiliary scaffold. The primary alcohol group facilitates straightforward derivatization, while the cyclic framework imparts resistance to racemization under standard reaction conditions.

Application

(1-Methylcyclobutyl)methanol serves as a versatile building block in synthetic organic chemistry, offering a rigid cyclobutane scaffold with a primary alcohol for downstream functionalization. Its bench-stable nature and tolerance to common reaction conditions enable efficient derivatization in medicinal chemistry and process development workflows. Functions as a key intermediate in the construction of bioactive heterocycles and cyclic alkyl motifs found in pharmaceutical candidates.

Synthesis

  • Route1

    References

    • Hill, E. Alexander; Hallade, Marc W. Journal of Organometallic Chemistry, 1988 , vol. 352, p. 263 - 272
  • Route2

    References

    • MEDIVIR AB Patent: WO2007/6716 A1, 2007 ; Location in patent: Page/Page column 57-58 ; WO 2007/006716 A1
  • Route3

    References

    • Cowling, Stephen J.; Goodby, John W. Chemical Communications, 2006 , # 39 p. 4107 - 4109

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02,GHS05,GHS07
Signal Word : Warning
UN#: 1987
Class : 3
Packing Group : Ⅲ
Hazard Statements : H226-H315-H319-H335
Precautionary Statements : P210-P240-P241-P242-P243-P261-P264-P271-P280-P302+P352-P304+P340-P362-P370+P378-P405-P501

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   1.1689
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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