Lot numbers can be found on the outside label of a product:
2-(3,5-Dimethoxyphenyl)acetic acid
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CAS No. 4670-10-4
- Cat. No. CS-W002109
- Purity≥97%
- MDL No.None
*For research and further manufacturing use only, not for direct human use.
Structure of 4670-10-4
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General Information
- CAS No. 4670-10-4
- Cat. No. CS-W002109
- Purity ≥97%
- MDL No. None
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₀H₁₂O₄
- Molecular Weight 196.20
- Synonym(s) 3,5-Dimethoxyphenylacetic acid
- SMILES COc1cc(CC(=O)O)cc(c1)OC
Description
This 2-(3,5-dimethoxyphenyl)acetic acid features a phenyl core with two methoxy groups in the meta and para positions relative to the acetic acid side chain. The electron-rich aromatic ring enhances reactivity in coupling reactions, while the carboxylic acid group enables direct functionalization or salt formation. Bench-stable and moisture-tolerant, it serves as a robust building block for pharmaceutical intermediates and bioactive molecule synthesis.
Application
2-(3,5-Dimethoxyphenyl)acetic acid serves as a versatile building block for the synthesis of bioactive molecules, particularly in medicinal chemistry and agrochemical development. Its ortho-dimethoxyaryl moiety provides enhanced metabolic stability and lipophilicity modulation. The carboxylic acid functional group enables straightforward derivatization via amide, ester, or acyl chloride formation, facilitating integration into complex scaffolds. Bench-stable and readily purified by recrystallization, it functions reliably in standard coupling protocols and multistep syntheses.
Synthesis
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Route1
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1141493-97-1 - ~99%
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In-stock
4670-10-4
References
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UNIVERSITY HEALTH NETWORK; LAUFER, Radoslaw; PAULS, Heinz W.; FEHER, Miklos; NG, Grace; LIU, Yong; EDWARDS, Louise G.; PATEL, Narendra Kumar B.; PAN, Guohua; MAK, Tak W. Patent: WO2011/123937 A1, 2011 ; Location in patent: Page/Page column 78 ; WO 2011/123937 A1
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Route2
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In-stock
13388-75-5 - ~91%
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In-stock
4670-10-4
References
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Kozlowski, Marisa C.; Dugan, Elizabeth C.; DiVirgilio, Evan S.; Maksimenka, Katja; Bringmann, Gerhard Advanced Synthesis and Catalysis, 2007 , vol. 349, # 4-5 p. 583 - 594
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Route3
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In-stock
6512-32-9 - ~91%
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In-stock
4670-10-4
References
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Liang, Qiren; Zhang, Jiyong; Quan, Weiguo; Sun, Yongquan; She, Xuegong; Pan, Xinfu Journal of Organic Chemistry, 2007 , vol. 72, # 7 p. 2694 - 2697
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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 : H315-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 55.76
- LogP 1.3309
- H_Acceptors 3
- H_Donors 1
- Rotatable_Bonds 4
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Key Words
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