Methyl 4-aminobicyclo[2.2.1]heptane-1-carboxylate

CAS No. 1252672-38-0
Cat. No. CS-0049055
Molecule weight169.22
Purity≥96%
MDL No.MFCD23378922

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Methyl 4-aminobicyclo[2.2.1]heptane-1-carboxylate|CS-0049055

Structure of 1252672-38-0

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General Information

CAS No. 1252672-38-0
Cat. No. CS-0049055
Purity ≥96%
MDL No. MFCD23378922
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₁₅NO₂
Molecular Weight 169.22
Synonym(s) Bicyclo[2.2.1]heptane-1-carboxylic acid, 4-amino-, methyl ester
SMILES O=C(OC)[C@@]1(C2)CC[C@]2(N)CC1

Description

Methyl 4-aminobicyclo[2.2.1]heptane-1-carboxylate features a rigid bicyclic scaffold that imparts conformational stability, while the pendant amine and ester groups enable versatile functionalization. This bifunctional architecture supports efficient incorporation into bioactive molecules, particularly in medicinal chemistry campaigns targeting CNS modulators and enzyme inhibitors.

Application

Methyl 4-aminobicyclo[2.2.1]heptane-1-carboxylate serves as a versatile bicyclic scaffold for medicinal chemistry and synthetic applications. The strained cyclohexane framework provides rigidity, while the pendant amine and ester groups enable diverse functionalization. It facilitates efficient derivatization via standard amine alkylation, acylation, or ester hydrolysis, and functions as a key building block in the synthesis of constrained heterocycles and bioactive molecules. Bench-stable and readily purified, it supports scalable transformations in target-oriented synthesis.

Safety Information

Download SDS

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

TPSA 52.32
LogP 0.821
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Bridge Rings compounds Other bridge ring compounds

Key Words

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Methyl 4-aminobicyclo[2.2.1]heptane-1-carboxylate

CAS No. 1252672-38-0

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