tert-Butyl 3,4-dihydropyridine-1(2H)-carboxylate

Name: tert-Butyl 3,4-dihydropyridine-1(2H)-carboxylate
Brand: ChemScene
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CAS No. 131667-57-7
Cat. No. CS-0009353
Purity≥95%
MDL No.MFCD00798175

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tert-Butyl 3,4-dihydropyridine-1(2H)-carboxylate|CS-0009353

Structure of 131667-57-7

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Description

tert-Butyl 3,4-dihydropyridine-1(2H)-carboxylate serves as a stable, bench-ready synthon for pyridine-based scaffolds. The dihydropyridine core features a reducible, electron-rich heterocycle that integrates readily into complex molecular architectures. This derivative enables efficient access to functionalized nitrogen-containing frameworks under mild reaction conditions.

Application

tert-Butyl 3,4-dihydropyridine-1(2H)-carboxylate serves as a versatile synthetic intermediate for the construction of pyridine and dihydropyridine scaffolds. Its readily accessible dihydropyridine core enables selective oxidation to pyridines or functionalization at C3/C4 positions. The tert-butyl ester group provides excellent bench stability, facilitates purification, and allows for straightforward deprotection under mild acidic conditions, making it well-suited for medicinal chemistry campaigns and multistep synthesis.

General Information

CAS No. 131667-57-7
Cat. No. CS-0009353
Purity ≥95%
MDL No. MFCD00798175
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₁₇NO₂
Molecular Weight 183.25
Synonym(s) 1-N-Boc-3,4-dihydro-2H-pyridine
SMILES O=C(N1C=CCCC1)OC(C)(C)C

Computational Chemistry Data

TPSA 29.54
LogP 2.531
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 0

Safety Information

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GHS Pictogram :	GHS No : GHS06,GHS09
Signal Word : Danger	UN#: 2810
Class : 6.1	Packing Group : Ⅲ
Hazard Statements : H301-H410
Precautionary Statements : P264-P270-P273-P330-P391-P405-P501

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Other Classifications

Building Blocks Skeleton Aliphatic heterocycle compounds Other aliphatic heterocycles compounds

Key Words

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tert-Butyl 3,4-dihydropyridine-1(2H)-carboxylate

CAS No. 131667-57-7

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