Lot numbers can be found on the outside label of a product:
1-(4-Nitrophenyl)piperidin-4-one
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CAS No. 23499-01-6
- Cat. No. CS-0157618
- Purity≥98%
- MDL No.MFCD00231570
*For research and further manufacturing use only, not for direct human use.
Structure of 23499-01-6
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General Information
- CAS No. 23499-01-6
- Cat. No. CS-0157618
- Purity ≥98%
- MDL No. MFCD00231570
- Storage 4°C
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₁H₁₂N₂O₃
- Molecular Weight None
- Synonym(s) 1-(4-NITROPHENYL)PIPERIDINE-4-ONE
- SMILES C1=C(C=CC(=C1)[N+](=O)[O-])N2CCC(=O)CC2
Description
1-(4-Nitrophenyl)piperidin-4-one features a conjugated nitroaryl group fused to a piperidinone scaffold, enabling strong electron-withdrawing effects and enhanced stability. This structural motif facilitates integration into pharmaceutical intermediates and functional materials, particularly in the development of kinase inhibitors and bioactive heterocycles under standard bench conditions.
Application
1-(4-Nitrophenyl)piperidin-4-one serves as a versatile building block in medicinal chemistry, enabling efficient access to substituted piperidinone scaffolds. Its nitro group facilitates subsequent reduction and functionalization, while the ketone supports enolate chemistry and nucleophilic additions. The compound exhibits bench stability and compatibility with standard synthetic protocols, making it valuable for constructing heterocyclic intermediates and drug-like molecules in iterative synthesis workflows.
Synthesis
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Route1
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In-stock
350-46-9 - ~37%
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In-stock
23499-01-6
References
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F2G LTD Patent: WO2006/123145 A1, 2006 ; Location in patent: Page/Page column 54-55 ;
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Route2
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41979-39-9 -
In-stock
350-46-9
- ~64%
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In-stock
23499-01-6
References
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Massa, S.; Mai, A.; Artico, M. Synthetic Communications, 1990 , vol. 20, # 22 p. 3537 - 3545
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Route3
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In-stock
79421-45-7 - ~79%
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In-stock
23499-01-6
References
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Taylor, Edward C.; Skotnicki, Jerauld S. Synthesis, 1981 , # 8 p. 606 - 608
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Safety Information
Download SDS|
GHS Pictogram :
N/A
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GHS No : N/A
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Signal Word : N/A
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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 : N/A
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Precautionary Statements : N/A
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Quality Control
Computational Chemistry Data
- TPSA 63.45
- LogP 1.7641
- H_Acceptors 4
- H_Donors 0
- Rotatable_Bonds 2
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Key Words
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