tert-Butyl 4-nitropiperidine-1-carboxylate

Name: tert-Butyl 4-nitropiperidine-1-carboxylate
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CAS No. 1228630-89-4
Cat. No. CS-0036552
Purity≥95%
MDL No.MFCD16618559

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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tert-Butyl 4-nitropiperidine-1-carboxylate|CS-0036552

Structure of 1228630-89-4

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Description

tert-Butyl 4-nitropiperidine-1-carboxylate features a bench-stable, moisture-tolerant carbamate protecting group that enables straightforward incorporation of the nitropiperidine motif into complex molecular architectures. The para-nitro functionality delivers strong electron-withdrawing character, facilitating subsequent reductive transformations and enabling direct access to functionalized piperidines under mild conditions.

Application

tert-Butyl 4-nitropiperidine-1-carboxylate serves as a versatile building block in medicinal chemistry, enabling efficient access to piperidine-based scaffolds. The nitro group facilitates subsequent reductive transformations and cyclizations, while the tert-butyl carbamate provides orthogonal protection for nitrogen. Its bench-stable nature and compatibility with standard coupling and reduction protocols make it ideal for multi-step synthesis of bioactive molecules and API intermediates.

General Information

CAS No. 1228630-89-4
Cat. No. CS-0036552
Purity ≥95%
MDL No. MFCD16618559
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₁₈N₂O₄
Molecular Weight 230.26
Synonym(s) 4-Nitro-piperidine-1-carboxylic acid tert-butyl ester
SMILES O=C(N1CCC([N+]([O-])=O)CC1)OC(C)(C)C

Computational Chemistry Data

TPSA 72.68
LogP 1.6626
H_Acceptors 4
H_Donors 0
Rotatable_Bonds 1

Safety Information

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GHS Pictogram :	GHS No : GHS06
Signal Word : Danger	UN#: 2811
Class : 6.1	Packing Group : Ⅲ
Hazard Statements : H301-H315-H319
Precautionary Statements : P264-P270-P280-P302+P352-P330-P362+P364-P405-P501

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Other Classifications

Building Blocks Functional Group Nitro compounds

Building Blocks Skeleton Aliphatic heterocycle compounds Piperidine compounds

Key Words

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tert-Butyl 4-nitropiperidine-1-carboxylate

CAS No. 1228630-89-4

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