Lot numbers can be found on the outside label of a product:
2-(Methoxycarbonyl)isonicotinic acid
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CAS No. 24195-10-6
- Cat. No. CS-W021441
- Purity≥97%
- MDL No.MFCD00661398
*For research and further manufacturing use only, not for direct human use.
Structure of 24195-10-6
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General Information
- CAS No. 24195-10-6
- Cat. No. CS-W021441
- Purity ≥97%
- MDL No. MFCD00661398
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₈H₇NO₄
- Molecular Weight 181.15
- Synonym(s) 2,4-Pyridinedicarboxylic acid, 2-Methyl ester
- SMILES COC(=O)C1=CC(=CC=N1)C(O)=O
Description
2-(Methoxycarbonyl)isonicotinic acid serves as a key synthetic intermediate for bioactive heterocycles and pharmaceutical scaffolds. This electron-deficient pyridine carboxylic acid features a methoxycarbonyl group at the 2-position, enhancing reactivity in coupling and cyclization processes. The molecule exhibits good solubility in common organic solvents and stability under standard bench conditions, facilitating its integration into multi-step synthesis workflows.
Application
2-(Methoxycarbonyl)isonicotinic acid serves as a versatile building block in medicinal chemistry and heterocyclic synthesis, enabling efficient access to pyridine-based pharmacophores. Its dual functionality—pyridine nitrogen and ester group—facilitates selective derivatization via nucleophilic substitution, coupling reactions, and cyclization cascades. The compound exhibits excellent bench stability and is readily purified by recrystallization, supporting reliable use in scale-up and multi-step synthesis workflows.
Synthesis
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Route1
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25658-36-0 - ~26%
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In-stock
24195-10-6
References
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Wang, Xue-Bin; Dacres, Jelena E.; Yang, Xin; Broadus, Katherine M.; Lis, Lev; Wang, Lai-Sheng; Kass, Steven R. Journal of the American Chemical Society, 2003 , vol. 125, # 1 p. 296 - 304
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Route2
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67-56-1 -
In-stock
499-80-9 - ~%
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In-stock
24195-10-6
References
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Yamanouchi Pharmaceutical Co. Ltd. Patent: US6673799 B1, 2004 ; Location in patent: Page column 16 ;
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Route3
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In-stock
499-80-9
- ~%
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In-stock
24195-10-6
References
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Wang, Xue-Bin; Dacres, Jelena E.; Yang, Xin; Broadus, Katherine M.; Lis, Lev; Wang, Lai-Sheng; Kass, Steven R. Journal of the American Chemical Society, 2003 , vol. 125, # 1 p. 296 - 304
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H315-H319-H335
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Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 76.49
- LogP 0.5664
- H_Acceptors 4
- H_Donors 1
- Rotatable_Bonds 2
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Key Words
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