Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate

Name: Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate
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CAS No. 1196-90-3
Cat. No. CS-0037227
Purity≥98%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
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Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate|CS-0037227

Structure of 1196-90-3

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Description

Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate features a brominated pyrrole core with a methyl ester at the C2 position, enabling direct incorporation into cross-coupling and cyclization reactions. The electron-deficient pyrrole ring facilitates nucleophilic substitution, while the bench-stable ester group supports straightforward derivatization in synthetic workflows.

Application

Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate serves as a versatile building block in heterocyclic synthesis, enabling palladium-catalyzed cross-coupling reactions due to its well-defined bromine handle. The methylpyrrole core offers enhanced stability and favorable solubility, while the ester group allows for selective transformations. This compound facilitates efficient access to substituted pyrrole scaffolds relevant in medicinal chemistry and agrochemical development, with predictable reactivity under standard conditions.

General Information

CAS No. 1196-90-3
Cat. No. CS-0037227
Purity ≥98%
MDL No. None
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₈BrNO₂
Molecular Weight 218.05
Synonym(s) None
SMILES CN1C=C(C=C1C(=O)OC)Br

Computational Chemistry Data

TPSA 31.23
LogP 1.5742
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 1

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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Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Pyrrole compounds

Key Words

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Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate

CAS No. 1196-90-3

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