Lot numbers can be found on the outside label of a product:
Methyl 2-(6-chloropyridin-3-yl)acetate
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CAS No. 717106-69-9
- Cat. No. CS-W005153
- Purity≥95%
- MDL No.MFCD15526721
*For research and further manufacturing use only, not for direct human use.
Structure of 717106-69-9
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General Information
- CAS No. 717106-69-9
- Cat. No. CS-W005153
- Purity ≥95%
- MDL No. MFCD15526721
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₈H₈ClNO₂
- Molecular Weight 185.61
- Synonym(s) Methyl (6-chloro-3-pyridinyl)acetate
- SMILES O=C(OC)CC1=CC=C(Cl)N=C1
Description
Methyl 2-(6-chloropyridin-3-yl)acetate features a chloropyridine moiety linked via a methylene bridge to an ester group, enabling direct functionalization at the acetyl position. This bench-stable compound serves as a key intermediate in synthesizing bioactive heterocycles, particularly in pharmaceuticals targeting kinase pathways. The electron-deficient pyridine ring enhances reactivity in nucleophilic substitution processes.
Application
Methyl 2-(6-chloropyridin-3-yl)acetate serves as a versatile building block in medicinal chemistry, enabling efficient access to pyridine-containing scaffolds via palladium-catalyzed cross-coupling reactions. The ester functionality facilitates downstream derivatization, while the 6-chloropyridin-3-yl group provides a reliable handle for C–H functionalization and heterocycle construction. Bench-stable and compatible with standard synthetic workflows, it supports scalable synthesis of bioactive molecules.
Synthesis
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Route1
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In-stock
39891-13-9 -
75-36-5 - ~97%
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In-stock
717106-69-9
References
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Leivers, Martin; Miller, John Patent: US2011/52534 A1, 2011 ; Location in patent: Page/Page column 90 ;
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Route2
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In-stock
39891-13-9
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18107-18-1
- ~99%
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In-stock
717106-69-9
References
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DOW AGROSCIENCES LLC Patent: WO2004/57960 A2, 2004 ; Location in patent: Page 13-14 ;
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Route3
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67-56-1
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In-stock
39891-13-9
- ~%
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In-stock
717106-69-9
References
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Holla, B. Shivarama; Prasanna; Poojary, Boja; Rao; Shridhara; Bhat, U. Ganesha Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2004 , vol. 43, # 4 p. 864 - 868
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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 39.19
- LogP 1.4505
- H_Acceptors 3
- H_Donors 0
- Rotatable_Bonds 2
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Key Words
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