Lot numbers can be found on the outside label of a product:
1-tert-Butyl 4-methyl 4-hydroxypiperidine-1,4-dicarboxylate
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CAS No. 495415-09-3
- Cat. No. CS-0038556
- Purity≥97%
- MDL No.MFCD11845429
*For research and further manufacturing use only, not for direct human use.
Structure of 495415-09-3
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General Information
- CAS No. 495415-09-3
- Cat. No. CS-0038556
- Purity ≥97%
- MDL No. MFCD11845429
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₂H₂₁NO₅
- Molecular Weight 259.30
- Synonym(s) Methyl 1-Boc-4-hydroxypiperidine-4-carboxylate
- SMILES CC(C)(OC(N1CCC(C(OC)=O)(O)CC1)=O)C
Description
1-tert-Butyl 4-methyl 4-hydroxypiperidine-1,4-dicarboxylate features a sterically shielded piperidine core with orthogonal functional handles: a bench-stable hydroxyl group and two ester moieties. This configuration enables selective derivatization in complex molecule assembly, particularly in medicinal chemistry scaffolds requiring controlled polarity and metabolic stability.
Application
1-tert-Butyl 4-methyl 4-hydroxypiperidine-1,4-dicarboxylate serves as a versatile scaffold for the synthesis of piperidine-based building blocks. The hydroxyl group enables selective derivatization via esterification or protection, while the tert-butyl and methyl esters offer orthogonal deprotection options. Its bench-stable nature and compatibility with standard coupling and cyclization protocols facilitate efficient access to complex heterocyclic intermediates in medicinal chemistry and API development.
Synthesis
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Route1
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60437-30-1 - ~%
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In-stock
495415-09-3
References
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THE GENERAL HOSPITAL CORPORATION; ANNOVATION BIOPHARMA, LLC; RAINES, Douglas, E.; HUSAIN, Syed Shaukat; RANDLE, John, C.R. Patent: WO2013/106717 A1, 2013 ; Location in patent: Paragraph 00207 ;
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Route2
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3612-20-2 - ~%
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In-stock
495415-09-3
References
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THE GENERAL HOSPITAL CORPORATION; ANNOVATION BIOPHARMA, LLC; RAINES, Douglas, E.; HUSAIN, Syed Shaukat; RANDLE, John, C.R. Patent: WO2013/106717 A1, 2013 ;
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Route3
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6094-60-6 - ~%
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In-stock
495415-09-3
References
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THE GENERAL HOSPITAL CORPORATION; ANNOVATION BIOPHARMA, LLC; RAINES, Douglas, E.; HUSAIN, Syed Shaukat; RANDLE, John, C.R. Patent: WO2013/106717 A1, 2013 ;
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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-P330-P501
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Quality Control
Computational Chemistry Data
- TPSA 76.07
- LogP 0.9214
- H_Acceptors 5
- H_Donors 1
- Rotatable_Bonds 1
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Key Words
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