Methyl 2-bromo-5-formylbenzoate

Name: Methyl 2-bromo-5-formylbenzoate
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CAS No. 1043418-95-6
Cat. No. CS-0150827
Purity≥96%
MDL No.MFCD26863463

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Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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Methyl 2-bromo-5-formylbenzoate|CS-0150827

Structure of 1043418-95-6

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General Information

CAS No. 1043418-95-6
Cat. No. CS-0150827
Purity ≥96%
MDL No. MFCD26863463
Storage 4°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₇BrO₃
Molecular Weight 243.06
Synonym(s) Benzoic acid, 2-bromo-5-formyl-, methyl ester
SMILES COC(=O)C1=CC(=CC=C1Br)C=O

Description

Methyl 2-bromo-5-formylbenzoate features a strategically positioned formyl group flanked by bromine and ester functionalities, enabling direct incorporation into cross-coupling and functionalization cascades. This ortho-brominated aromatic scaffold supports diverse transformations under standard conditions, delivering high chemoselectivity in complex molecule assembly.

Application

Methyl 2-bromo-5-formylbenzoate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to substituted aromatic scaffolds. The bromo group facilitates palladium-catalyzed cross-coupling reactions, while the formyl functionality supports nucleophilic additions and condensation processes. Its bench-stable nature and compatibility with common protecting groups make it well-suited for multi-step synthesis of heterocyclic systems and complex molecular architectures.

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 43.37
LogP 2.0482
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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Methyl 2-bromo-5-formylbenzoate

CAS No. 1043418-95-6

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