Lot numbers can be found on the outside label of a product:
4-Methyl-1-piperazinecarboxaldehyde
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CAS No. 7556-55-0
- Cat. No. CS-0206481
- Purity≥98%
- MDL No.MFCD00085930
*For research and further manufacturing use only, not for direct human use.
Structure of 7556-55-0
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General Information
- CAS No. 7556-55-0
- Cat. No. CS-0206481
- Purity ≥98%
- MDL No. MFCD00085930
- Storage 4°C, protect from light, stored under nitrogen
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₆H₁₂N₂O
- Molecular Weight 128.17
- Synonym(s) 1-Formyl-4-methylpiperazine
- SMILES CN1CCN(CC1)C=O
Description
4-Methyl-1-piperazinecarboxaldehyde features a reactive aldehyde group appended to a nitrogen-rich piperazine ring, enabling efficient conjugation in bioconjugation and medicinal chemistry applications. The methyl substituent enhances solubility and metabolic stability while preserving reactivity. This compound serves as a key scaffold for targeted drug discovery and functionalized probe development under standard conditions.
Application
4-Methyl-1-piperazinecarboxaldehyde serves as a versatile building block in medicinal chemistry, enabling rapid access to diverse heterocyclic scaffolds through reductive amination, condensation, and cyclization reactions. Its aldehyde functionality exhibits high reactivity with amines and hydrazides under mild conditions, facilitating the construction of imines and hydrazones. The piperazine core provides enhanced solubility and metabolic stability, while the methyl group offers a handle for further functionalization. Bench-stable and readily purified by distillation or chromatography, it functions effectively in multi-step syntheses of bioactive molecules.
Synthesis
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Route1
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In-stock
109-01-3 -
64-18-6 - ~80%
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In-stock
7556-55-0
References
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Khromov-Borisov, N. V.; Aleksandrova, L. N.; Danilov, A. F.; Shelkovnikov, S. A. Pharmaceutical Chemistry Journal, 1984 , vol. 18, # 6 p. 401 - 403 Khimiko-Farmatsevticheskii Zhurnal, 1984 , vol. 18, # 6 p. 689 - 691
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Route2
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In-stock
109-01-3
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124-38-9
- ~91%
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In-stock
7556-55-0
References
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Cui, Xinjiang; Zhang, Yan; Deng, Youquan; Shi, Feng Chemical Communications, 2014 , vol. 50, # 2 p. 189 - 191
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Route3
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In-stock
109-01-3
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50-00-0
- ~41%
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In-stock
7556-55-0
References
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Saidi, Ourida; Bamford, Mark J.; Blacker, A. John; Lynch, James; Marsden, Stephen P.; Plucinski, Pawel; Watson, Robert J.; Williams, Jonathan M.J. Tetrahedron Letters, 2010 , vol. 51, # 44 p. 5804 - 5806
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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-H335
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Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 23.55
- LogP -0.6098
- H_Acceptors 2
- H_Donors 0
- Rotatable_Bonds 1
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Key Words
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