tert-Butyl 3-(piperidin-4-yl)propanoate

Name: tert-Butyl 3-(piperidin-4-yl)propanoate
Brand: ChemScene
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CAS No. 1249815-81-3
Cat. No. CS-0106065
Molecule weight213.32
Purity≥97%
MDL No.None

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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+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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tert-Butyl 3-(piperidin-4-yl)propanoate|CS-0106065

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General Information

CAS No. 1249815-81-3
Cat. No. CS-0106065
Purity ≥97%
MDL No. None
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₂₃NO₂
Molecular Weight 213.32
Synonym(s) None
SMILES O=C(OC(C)(C)C)CCC1CCNCC1

Description

tert-Butyl 3-(piperidin-4-yl)propanoate features a piperidine ring tethered to a propanoate ester, offering a robust, bench-stable scaffold for medicinal chemistry. The tertiary butyl group enables facile deprotection under mild acidic conditions, while the aliphatic chain provides flexibility for conjugation. This compound serves as a key intermediate in synthesizing bioactive molecules, particularly those targeting G-protein-coupled receptors and kinase pathways.

Application

tert-Butyl 3-(piperidin-4-yl)propanoate serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive scaffolds through standard amide bond formation and reductive amination. The piperidine moiety provides a basic nitrogen for salt formation and hydrogen bonding, while the tert-butyl ester offers bench stability and facile deprotection under mild acidic conditions. Its functional group tolerance facilitates integration into complex molecular architectures.

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 38.33
LogP 2.1079
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aliphatic heterocycle compounds Piperidine compounds

Key Words

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tert-Butyl 3-(piperidin-4-yl)propanoate

CAS No. 1249815-81-3

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