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CS-W001157 4
Total: USD 88.00

2-Methylcyclopentane-1-carboxylic acid

  • CAS No. 5454-78-4

  • Cat. No. CS-0047145
  • Purity≥97%
  • MDL No.MFCD11655621

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

2-Methylcyclopentane-1-carboxylic acid|CS-0047145

Structure of 5454-78-4

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General Information

  • CAS No. 5454-78-4
  • Cat. No. CS-0047145
  • Purity ≥97%
  • MDL No. MFCD11655621
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₂O₂
  • Molecular Weight None
  • Synonym(s) 2-Methylcyclopentanecarboxylic acid
  • SMILES O=C(C1C(CCC1)C)O

Description

2-Methylcyclopentane-1-carboxylic acid features a rigid cyclopentane core with a methyl substituent and a carboxylic acid group, offering enhanced steric definition and polarity. This structural motif enables integration into bioactive molecules requiring conformational constraint and improved solubility profiles in medicinal chemistry applications.

Application

2-Methylcyclopentane-1-carboxylic acid serves as a versatile building block in medicinal chemistry and synthetic organic research, offering a rigid, lipophilic cyclopentane core with a carboxylic acid handle for derivatization. Its bench-stable nature and compatibility with standard coupling reactions facilitate efficient access to bioactive scaffolds and analogs in drug discovery campaigns.

Safety Information

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GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   1.5072
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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