Lot numbers can be found on the outside label of a product:
Benzyl 4-(hydroxymethyl)piperidine-1-carboxylate
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CAS No. 122860-33-7
- Cat. No. CS-W002888
- Purity≥97%
- MDL No.MFCD02094490
*For research and further manufacturing use only, not for direct human use.
Structure of 122860-33-7
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General Information
- CAS No. 122860-33-7
- Cat. No. CS-W002888
- Purity ≥97%
- MDL No. MFCD02094490
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₄H₁₉NO₃
- Molecular Weight 249.31
- Synonym(s) N-CBZ-4-piperidine methanol
- SMILES OCC1CCN(CC1)C(=O)OCc1ccccc1
Description
Benzyl 4-(hydroxymethyl)piperidine-1-carboxylate features a piperidine core functionalized with a hydroxymethyl group and a benzyl ester, enabling direct incorporation into complex molecular architectures. This bench-stable derivative facilitates efficient downstream transformations in medicinal chemistry campaigns.
Application
Benzyl 4-(hydroxymethyl)piperidine-1-carboxylate serves as a versatile building block in medicinal chemistry, enabling efficient access to piperidine-based scaffolds. The hydroxymethyl group facilitates downstream functionalization via oxidation, substitution, or cyclization reactions, while the benzyl carbamate offers robust protection of the amine with excellent bench stability and ease of removal under standard hydrogenolysis conditions. Its compatibility with diverse synthetic transformations makes it ideal for constructing bioactive molecules and API intermediates.
Synthesis
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Route1
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In-stock
6457-49-4 -
501-53-1 - ~90%
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In-stock
122860-33-7
References
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INSTITUT PASTEUR KOREA; KIM, Junwon; CECHETTO, Jonathan; NO, Zaesung; CHRISTOPHE, Thierry; KIM, Taehee; NAM, Ji, Youn; SO, Wonyoung; JO, Mina; OK, Taedong; PARK, Changmin; SEO, Min, Jung; SOHN, Jeong-Hun; SOMMER, Peter; BOESE, Annette, Sophia; HAN, Sung-Jun; PARK, Young, Sam; KIM, Hwa, Pyung Patent: WO2010/46780 A2, 2010 ; Location in patent: Page/Page column 63-64 ;
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Route2
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In-stock
6457-49-4
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1885-14-9
- ~44%
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In-stock
122860-33-7
References
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SmithKline Beecham plc Patent: EP1051413 B1, 2003 ;
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Route3
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501-53-1
- ~45%
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In-stock
122860-33-7
References
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Fang, Xinqin; Garvey, David S.; Gaston, Ricky D.; Lin, Chia-En; Ranatunga, Ramani R.; Richardson, Stewart K.; Wang, Tiansheng; Wang, Weiheng; Wey, Shiow-Jyi Patent: US2003/203915 A1, 2003 ;
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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 49.77
- LogP 2.0275
- H_Acceptors 3
- H_Donors 1
- Rotatable_Bonds 3
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Key Words
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