Lot numbers can be found on the outside label of a product:
Ethyl 2-(4-iodophenyl)acetate
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CAS No. 15250-46-1
- Cat. No. CS-0084634
- Purity≥98%
- MDL No.MFCD07779004
*For research and further manufacturing use only, not for direct human use.
Structure of 15250-46-1
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General Information
- CAS No. 15250-46-1
- Cat. No. CS-0084634
- Purity ≥98%
- MDL No. MFCD07779004
- Storage 4°C, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₀H₁₁IO₂
- Molecular Weight 290.10
- Synonym(s) =-essigsaeure-aethylester
- SMILES O=C(OCC)CC1=CC=C(I)C=C1
Description
Ethyl 2-(4-iodophenyl)acetate is a bench-stable, moisture-tolerant building block featuring a para-iodinated phenyl ring coupled to an ethyl acetate handle. This structure enables direct coupling in palladium-catalyzed cross-coupling reactions, delivering functionalized arylated esters with high efficiency under standard conditions.
Application
Ethyl 2-(4-iodophenyl)acetate serves as a versatile building block for Suzuki-Miyaura and other palladium-catalyzed cross-coupling reactions, enabling the construction of biaryl scaffolds under mild conditions. The iodide functionality exhibits high reactivity and compatibility with diverse functional groups, while the ester moiety provides a handle for further transformations. This compound offers excellent bench stability and ease of purification, making it well-suited for iterative synthesis in medicinal chemistry and process development workflows.
Synthesis
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Route1
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623-73-4 -
1338250-05-7
- ~83%
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In-stock
15250-46-1
References
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Elkin, Pavel K.; Levin, Vitalij V.; Dilman, Alexander D.; Struchkova, Marina I.; Belyakov, Pavel A.; Arkhipov, Dmitry E.; Korlyukov, Alexander A.; Tartakovsky, Vladimir A. Tetrahedron Letters, 2011 , vol. 52, # 41 p. 5259 - 5263
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Route2
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In-stock
14062-25-0 - ~95%
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In-stock
15250-46-1
References
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Klapars, Artis; Buchwald, Stephen L. Journal of the American Chemical Society, 2002 , vol. 124, # 50 p. 14844 - 14845
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Route3
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64-17-5
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In-stock
1798-06-7 - ~99%
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In-stock
15250-46-1
References
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Fattorusso, Caterina; Gemma, Sandra; Butini, Stefania; Huleatt, Paul; Catalanotti, Bruno; Persico, Marco; De Angelis, Meri; Fiorini, Isabella; Nacci, Vito; Ramunno, Anna; Rodriquez, Manuela; Greco, Giovanni; Novellino, Ettore; Bergamini, Alberto; Marini, Stefano; Coletta, Massimo; Maga, Giovanni; Spadari, Silvio; Campiani, Giuseppe Journal of Medicinal Chemistry, 2005 , vol. 48, # 23 p. 7153 - 7165
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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-P302+P352-P304+P340
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Quality Control
Computational Chemistry Data
- TPSA 26.3
- LogP 2.3968
- H_Acceptors 2
- H_Donors 0
- Rotatable_Bonds 3
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Key Words
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