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CS-W001157 4
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3-Methylcyclopentane-1-carboxylic acid

  • CAS No. 24070-68-6

  • Cat. No. CS-0217541
  • Purity≥97%
  • MDL No.None

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

3-Methylcyclopentane-1-carboxylic acid|CS-0217541

Structure of 24070-68-6

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General Information

  • CAS No. 24070-68-6
  • Cat. No. CS-0217541
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₂O₂
  • Molecular Weight 128.17
  • Synonym(s) Cyclopentanecarboxylic acid, 3-methyl- (7CI,8CI,9CI)
  • SMILES CC1CCC(C1)C(=O)O

Description

3-Methylcyclopentane-1-carboxylic acid features a rigid cyclopentane core with a strategically positioned carboxylic acid group and a methyl substituent, offering enhanced steric definition. This structural motif enables integration into bioactive molecules requiring conformational restraint, particularly in medicinal chemistry scaffolds where lipophilicity and metabolic stability are critical.

Application

3-Methylcyclopentane-1-carboxylic acid serves as a versatile scaffold for medicinal chemistry and natural product synthesis, offering a rigid cyclopentane core with defined stereochemistry. Its carboxylic acid functionality enables direct derivatization into amides, esters, and acyl chlorides, while the methyl substituent provides a site for further functionalization. The compound exhibits good bench stability and facilitates efficient purification via crystallization or chromatography, making it well-suited for high-throughput screening and route optimization in API development.

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3265
Class : 8
Packing Group : Ⅲ
Hazard Statements : H315-H318-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-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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