Benzyl 4-iodopiperidine-1-carboxylate

Name: Benzyl 4-iodopiperidine-1-carboxylate
Brand: ChemScene
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CAS No. 885275-00-3
Cat. No. CS-W006399
Purity≥95%
MDL No.MFCD04115043

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
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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Benzyl 4-iodopiperidine-1-carboxylate|CS-W006399

Structure of 885275-00-3

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Description

Benzyl 4-iodopiperidine-1-carboxylate features a reactive iodide at the piperidine ring's 4-position, enabling efficient cross-coupling transformations. The benzyl ester group provides solubility and stability under standard conditions, while the electron-deficient iodine facilitates palladium-catalyzed reactions. This compound serves as a key intermediate in the synthesis of bioactive nitrogen-containing architectures.

Application

Benzyl 4-iodopiperidine-1-carboxylate serves as a versatile building block in medicinal chemistry, enabling palladium-catalyzed cross-coupling reactions due to its stable iodo substituent. The benzyl ester group provides excellent bench stability and facilitates straightforward deprotection under standard hydrogenolysis conditions. Its functional group tolerance supports integration into complex molecular architectures, particularly for constructing piperidine-based scaffolds common in pharmaceutical research.

General Information

CAS No. 885275-00-3
Cat. No. CS-W006399
Purity ≥95%
MDL No. MFCD04115043
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₆INO₂
Molecular Weight 345.18
Synonym(s) 1-Piperidinecarboxylicacid, 4-iodo-, phenylmethyl ester
SMILES O=C(N1CCC(I)CC1)OCC2=CC=CC=C2

Computational Chemistry Data

TPSA 29.54
LogP 3.2226
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 2

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P260-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362+P364-P403+P233-P405-P501

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Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aliphatic heterocycle compounds Piperidine compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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Benzyl 4-iodopiperidine-1-carboxylate

CAS No. 885275-00-3

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