Lot numbers can be found on the outside label of a product:
2-(1H-indazol-1-yl)acetic acid
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CAS No. 32829-25-7
- Cat. No. CS-0465189
- Purity≥98%
- MDL No.MFCD02938037
*For research and further manufacturing use only, not for direct human use.
Structure of 32829-25-7
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General Information
- CAS No. 32829-25-7
- Cat. No. CS-0465189
- Purity ≥98%
- MDL No. MFCD02938037
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₉H₈N₂O₂
- Molecular Weight 176.17
- Synonym(s) Indazol-1-yl-Acetic Acid
- SMILES C1=CC=C2C(=C1)C=NN2CC(=O)O
Description
2-(1H-indazol-1-yl)acetic acid features a rigid indazole core linked via a methylene bridge to a carboxylic acid group, enabling direct integration into bioactive molecules. The electron-rich indazole moiety enhances π-stacking interactions in target binding pockets, while the pendant acid facilitates conjugation or salt formation for improved solubility and pharmacokinetic tuning.
Application
2-(1H-indazol-1-yl)acetic acid serves as a versatile building block for the synthesis of indazole-containing bioactive molecules, enabling direct conjugation to amine-functionalized scaffolds via amide bond formation. Its bench-stable carboxylic acid group exhibits excellent functional group tolerance and facilitates straightforward purification, making it well-suited for medicinal chemistry campaigns and API intermediate development.
Synthesis
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Route1
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1137062-64-6 - ~97%
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In-stock
32829-25-7
References
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VICURON PHARMACEUTICALS INC. Patent: US2006/211603 A1, 2006 ; Location in patent: Page/Page column 64 ;
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Route2
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In-stock
271-44-3 -
79-08-3
- ~33%
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In-stock
32829-25-7
References
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Shionogi and Co., Ltd. Patent: US5463107 A1, 1995 ;
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Route3
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954116-84-8 - ~94%
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In-stock
32829-25-7
References
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Teixeira, Fatima C.; Ramos, Helene; Antunes, Ines F.; Curto, M. Joao M.; Duarte, M. Teresa; Bento, Isabel Molecules, 2006 , vol. 11, # 11 p. 867 - 889
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS05,GHS07
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Signal Word : Danger
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UN#: 1759
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Class : 8
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Packing Group : Ⅲ
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Hazard Statements : H302-H318
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Precautionary Statements : P264-P270-P280-P330-P501
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Quality Control
Computational Chemistry Data
- TPSA 55.12
- LogP 1.1209
- H_Acceptors 3
- H_Donors 1
- Rotatable_Bonds 2
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Key Words
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