Lot numbers can be found on the outside label of a product:
Dimethyl pyridine-3,5-dicarboxylate
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CAS No. 4591-55-3
- Cat. No. CS-W001575
- Purity≥97%
- MDL No.MFCD00518827
*For research and further manufacturing use only, not for direct human use.
Structure of 4591-55-3
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General Information
- CAS No. 4591-55-3
- Cat. No. CS-W001575
- Purity ≥97%
- MDL No. MFCD00518827
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₉H₉NO₄
- Molecular Weight 195.17
- Synonym(s) 3,5-Pyridinedicarboxylic Acid Dimethyl Ester
- SMILES COC(=O)c1cncc(c1)C(=O)OC
Description
9-Fluorenone is used in the preparation of antimalarial drugs. It is a fluorene derivative. Further, it is used in functional polymer and in dyes.
Application
Dimethyl pyridine-3,5-dicarboxylate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to functionalized heterocycles and pharmaceutical intermediates. Its orthogonal ester groups facilitate selective transformations, while the electron-deficient pyridine core supports diverse coupling reactions. The compound exhibits excellent bench stability, ease of purification, and compatibility with standard reaction conditions, making it well-suited for iterative synthesis and scale-up applications.
Synthesis
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Route1
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67-56-1 -
In-stock
499-81-0 - ~90%
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In-stock
4591-55-3
References
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Fuller, Anne-Marie; Leigh, David A.; Lusby, Paul J.; Oswald, Iain D. H.; Parsons, Simon; Walker, D. Barney Angewandte Chemie - International Edition, 2004 , vol. 43, # 30 p. 3914 - 3918
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Route2
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In-stock
499-81-0
- ~78%
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In-stock
4591-55-3
References
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Mochida Pharmaceutical Co., Ltd. Patent: US6018046 A1, 2000 ;
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Route3
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592543-53-8
- ~76%
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In-stock
4591-55-3
References
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Bennasar, M.-Lluisa; Zulaica, Ester; Roca, Tomas; Alonso, Yolanda; Monerris, Manuel Tetrahedron Letters, 2003 , vol. 44, # 25 p. 4711 - 4714
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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 65.49
- LogP 0.6548
- H_Acceptors 5
- H_Donors 0
- Rotatable_Bonds 2
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