Lot numbers can be found on the outside label of a product:
Methyl 2-cyanonicotinate
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CAS No. 75358-89-3
- Cat. No. CS-0043877
- Purity≥98%
- MDL No.MFCD00128863
*For research and further manufacturing use only, not for direct human use.
Structure of 75358-89-3
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General Information
- CAS No. 75358-89-3
- Cat. No. CS-0043877
- Purity ≥98%
- MDL No. MFCD00128863
- Storage Store at room temperature, keep dry and cool
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₈H₆N₂O₂
- Molecular Weight 162.15
- Synonym(s) Methyl 2-Cyanopyridine-3-carboxylate
- SMILES O=C(OC)C1=C(C#N)N=CC=C1
Description
Methyl 2-cyanonicotinate features a cyano group at the pyridine ring’s 2-position, enhancing electrophilicity for nucleophilic substitution. This electron-deficient heterocycle integrates readily into synthetic scaffolds, enabling efficient access to functionalized pyridines under standard conditions.
Application
Methyl 2-cyanonicotinate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to pyridine-based heterocycles and pharmaceutical intermediates. Its dual functionality—cyano and ester groups—supports diverse transformations including nucleophilic additions, cyclizations, and metal-catalyzed couplings. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis workflows in medicinal chemistry and process development.
Synthesis
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Route1
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In-stock
73112-09-1 -
124-63-0 - ~31%
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In-stock
75358-89-3
References
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Spiessens, Luc I. M.; Anteunis, Marc J. O. Bulletin des Societes Chimiques Belges, 1980 , vol. 89, # 3 p. 205 - 232
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Route2
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67-56-1
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In-stock
5860-70-8 - ~75%
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In-stock
75358-89-3
References
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Spiessens, Luc I. M.; Anteunis, Marc J. O. Bulletin des Societes Chimiques Belges, 1980 , vol. 89, # 3 p. 205 - 232
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Route3
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In-stock
5860-70-8
- ~%
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In-stock
75358-89-3
References
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Bulletin des Societes Chimiques Belges, , vol. 89, # 3 p. 205 - 232
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Safety Information
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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 62.98
- LogP 0.73988
- H_Acceptors 4
- H_Donors 0
- Rotatable_Bonds 1
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