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2-(5-Fluoro-1H-indazol-3-yl)acetic acid

  • CAS No. 885271-22-7

  • Cat. No. CS-0102739
  • Molecule weight194.16
  • Purity≥98%
  • MDL No.MFCD06739143

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

2-(5-Fluoro-1H-indazol-3-yl)acetic acid|CS-0102739

Structure of 885271-22-7

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General Information

  • CAS No. 885271-22-7
  • Cat. No. CS-0102739
  • Purity ≥98%
  • MDL No. MFCD06739143
  • Storage -20°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇FN₂O₂
  • Molecular Weight 194.16
  • Synonym(s) (5-FLUORO-1H-INDAZOL-3-YL)-ACETIC ACID
  • SMILES O=C(O)CC1=NNC2=C1C=C(F)C=C2

Description

This 2-(5-fluoro-1H-indazol-3-yl)acetic acid features a fluorinated indazolyl core paired with a carboxylic acid side chain, enabling direct conjugation or metal chelation. The electron-deficient heterocycle enhances binding affinity in target-directed synthesis, while the pendant acid group facilitates derivatization under standard conditions. Bench-stable and moisture-tolerant, it serves as a key scaffold in medicinal chemistry campaigns targeting kinase and receptor systems.

Application

2-(5-Fluoro-1H-indazol-3-yl)acetic acid serves as a versatile building block for medicinal chemistry campaigns, enabling the rapid assembly of indazole-based bioactive molecules. Its carboxylic acid functionality facilitates direct coupling reactions and derivatization under standard conditions, while the 5-fluoro substitution enhances metabolic stability and modulates electronic properties. The compound exhibits excellent bench stability and compatibility with common purification methods, making it well-suited for high-throughput synthesis and structure-activity studies.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

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Computational Chemistry Data

  • TPSA   65.98
  • LogP   1.3291
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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