Lot numbers can be found on the outside label of a product:
6-Amino-4-methylnicotinonitrile
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CAS No. 179555-10-3
- Cat. No. CS-W022441
- Purity≥98%
- MDL No.MFCD09839255
*For research and further manufacturing use only, not for direct human use.
Structure of 179555-10-3
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General Information
- CAS No. 179555-10-3
- Cat. No. CS-W022441
- Purity ≥98%
- MDL No. MFCD09839255
- Storage 4°C, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₇H₇N₃
- Molecular Weight 133.15
- Synonym(s) 2-AMINO-5-CYANO-4-PICOLINE
- SMILES N#CC1=CN=C(N)C=C1C
Description
6-Amino-4-methylnicotinonitrile is a nitrogen-rich heterocyclic building block featuring a strategically positioned amino group and nitrile functionality. This scaffold integrates readily into medicinal chemistry campaigns, offering enhanced solubility and metabolic stability in bioactive molecule design.
Application
6-Amino-4-methylnicotinonitrile serves as a versatile building block in medicinal chemistry, enabling the synthesis of pyridine-based scaffolds through standard functional group transformations. Its amino and nitrile groups offer orthogonal reactivity for downstream derivatization, while the methyl substituent enhances metabolic stability. The compound exhibits good bench stability and is compatible with common coupling and cyclization protocols, facilitating efficient access to heterocyclic intermediates in API development.
Synthesis
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Route1
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In-stock
98198-48-2 -
544-92-3 - ~40%
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In-stock
179555-10-3
References
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Dunn; Norrie Advanced Synthesis and Catalysis, 1996 , vol. 338, # 7 p. 663 - 666
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Route2
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In-stock
98198-48-2
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107-15-3
- ~%
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In-stock
179555-10-3
References
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US2004/77605 A1, ; US 20040077605 A1
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Route3
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In-stock
98198-48-2
- ~62%
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In-stock
179555-10-3
References
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Merck and Co., Inc. Patent: US5972975 A1, 1999 ;
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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-H319
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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 62.7
- LogP 0.8439
- H_Acceptors 3
- H_Donors 1
- Rotatable_Bonds 0
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Key Words
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