Lot numbers can be found on the outside label of a product:
Methyl 3-(2-hydroxyphenyl)propanoate
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CAS No. 20349-89-7
- Cat. No. CS-0356885
- Purity≥96%
- MDL No.MFCD00067757
*For research and further manufacturing use only, not for direct human use.
Structure of 20349-89-7
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General Information
- CAS No. 20349-89-7
- Cat. No. CS-0356885
- Purity ≥96%
- MDL No. MFCD00067757
- Storage 4°C, stored under nitrogen
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₀H₁₂O₃
- Molecular Weight 180.20
- Synonym(s) Methyl 3-(2-hydroxyphenyl)propionate
- SMILES O=C(OC)CCC1=CC=CC=C1O
Description
Methyl 3-(2-hydroxyphenyl)propanoate features a phenolic hydroxyl group flanked by a benzylic methylene and an ester functionality, enabling direct conjugation or derivatization. This scaffold delivers enhanced solubility in polar solvents while maintaining stability under standard bench conditions, facilitating integration into synthetic routes requiring bioactive aromatic motifs.
Application
Methyl 3-(2-hydroxyphenyl)propanoate serves as a versatile synthetic building block for the construction of bioactive heterocycles and natural product analogs. Its ortho-hydroxyaryl motif enables facile intramolecular cyclization, while the ester group offers compatibility with standard transformations including reduction, hydrolysis, and coupling reactions. The compound exhibits good bench stability and is readily purified by recrystallization or column chromatography, making it well-suited for iterative synthesis in medicinal chemistry and process development workflows.
Synthesis
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Route1
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6236-69-7 - ~96%
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In-stock
20349-89-7
References
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Williams, John D.; Khan, Atiyya R.; Cardinale, Steven C.; Butler, Michelle M.; Bowlin, Terry L.; Peet, Norton P. Bioorganic and Medicinal Chemistry, 2014 , vol. 22, # 1 p. 419 - 434
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Route2
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In-stock
77086-38-5 -
![Methyl 4H-benzo[e][1,2]oxazine-3-carboxylate|CS-0602994](https://file.chemscene.com/productPIC/CS-0602994.gif)
538342-16-4 - ~85%
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In-stock
20349-89-7
References
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Sugimoto, Hiromichi; Nakamura, Satoshi; Ohwada, Tomohiko Advanced Synthesis and Catalysis, 2007 , vol. 349, # 4-5 p. 669 - 679
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Route3
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186581-53-3
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In-stock
495-78-3 - ~10%
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In-stock
20349-89-7
References
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Barton, Patrick; Laws, Andrew P.; Page, Michael I. Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1994 , # 9 p. 2021 - 2030
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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
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Precautionary Statements : P264-P270-P501
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Quality Control
Computational Chemistry Data
- TPSA 46.53
- LogP 1.4978
- H_Acceptors 3
- H_Donors 1
- Rotatable_Bonds 3
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Key Words
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