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CS-W001157 4
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1-(Thiophen-2-yl)cyclopropanecarboxylic acid

  • CAS No. 162959-94-6

  • Cat. No. CS-W021264
  • Purity≥97%
  • MDL No.MFCD16622241

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

1-(Thiophen-2-yl)cyclopropanecarboxylic acid|CS-W021264

Structure of 162959-94-6

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General Information

  • CAS No. 162959-94-6
  • Cat. No. CS-W021264
  • Purity ≥97%
  • MDL No. MFCD16622241
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈O₂S
  • Molecular Weight 168.21
  • Synonym(s) 1-thiophen-2-ylcyclopropane-1-carboxylic acid
  • SMILES O=C(C1(C2=CC=CS2)CC1)O

Description

1-(Thiophen-2-yl)cyclopropanecarboxylic acid features a rigid cyclopropane ring fused to a thiophene moiety, delivering enhanced structural rigidity and electron-rich character. This scaffold enables efficient integration into bioactive molecules, particularly in medicinal chemistry applications where metabolic stability and defined conformation are critical. The carboxylic acid group supports direct derivatization or salt formation for improved solubility and handling under standard conditions.

Application

1-(Thiophen-2-yl)cyclopropanecarboxylic acid serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocyclic scaffolds. Its cyclopropyl carboxylic acid motif offers enhanced metabolic stability and conformational rigidity, while the thiophene ring provides π-stacking and dipole interactions. The compound exhibits excellent bench stability, tolerates diverse functional groups, and facilitates straightforward derivatization via standard amide or ester formation—ideal for lead optimization campaigns.

Safety Information

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GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅱ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   1.8643
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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