2-(3-Bromo-2-methylphenyl)acetic acid

Name: 2-(3-Bromo-2-methylphenyl)acetic acid
Brand: ChemScene
Availability: InStock
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CAS No. 1261618-03-4
Cat. No. CS-0373036
Purity≥96%
MDL No.MFCD18392222

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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2-(3-Bromo-2-methylphenyl)acetic acid|CS-0373036

Structure of 1261618-03-4

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Description

This brominated aromatic acetic acid features a sterically hindered 3-bromo-2-methylphenyl group attached to a carboxylic acid-bearing side chain. The electron-deficient aryl moiety enables efficient coupling reactions, while the pendant acid facilitates derivatization or salt formation. Bench-stable and moisture-tolerant, this compound serves as a key intermediate in medicinal chemistry and materials synthesis.

Application

2-(3-Bromo-2-methylphenyl)acetic acid serves as a versatile building block for the synthesis of biologically active molecules, particularly in medicinal chemistry and agrochemical research. Its bromo group enables palladium-catalyzed cross-coupling reactions, while the carboxylic acid facilitates derivatization via amide or ester formation. The ortho-methyl substituent enhances metabolic stability and influences electronic properties, making this compound a practical scaffold for target-directed synthesis.

General Information

CAS No. 1261618-03-4
Cat. No. CS-0373036
Purity ≥96%
MDL No. MFCD18392222
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₉BrO₂
Molecular Weight 229.07
Synonym(s) 3-Bromo-2-methylbenzeneacetic acid
SMILES O=C(O)CC1=CC=CC(Br)=C1C

Computational Chemistry Data

TPSA 37.3
LogP 2.38462
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 2

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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Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-(3-Bromo-2-methylphenyl)acetic acid

CAS No. 1261618-03-4

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