2-(4-Bromo-3-methylphenyl)acetic acid

Name: 2-(4-Bromo-3-methylphenyl)acetic acid
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CAS No. 215949-57-8
Cat. No. CS-W006038
Purity≥95%
MDL No.MFCD02664811

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2-(4-Bromo-3-methylphenyl)acetic acid|CS-W006038

Structure of 215949-57-8

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General Information

CAS No. 215949-57-8
Cat. No. CS-W006038
Purity ≥95%
MDL No. MFCD02664811
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₉BrO₂
Molecular Weight 229.07
Synonym(s) (4-Bromo-3-methylphenyl)acetic acid
SMILES O=C(O)CC1=CC=C(Br)C(C)=C1

Description

This brominated arylacetic acid features a para-bromo and meta-methyl substitution pattern on the phenyl ring, delivering enhanced electronic modulation and steric profile. The carboxylic acid functionality enables direct coupling or derivatization in synthetic routes. Bench-stable and moisture-tolerant, it serves as a key building block for pharmaceutical intermediates and functional materials.

Application

2-(4-Bromo-3-methylphenyl)acetic acid serves as a versatile building block for the synthesis of biologically active molecules, particularly in medicinal chemistry and agrochemical research. Its structure features a brominated aromatic ring with a pendant acetic acid side chain, enabling diverse functionalization via palladium-catalyzed cross-coupling reactions. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for use in multi-step synthetic sequences.

Safety Information

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Computational Chemistry Data

TPSA 37.3
LogP 2.38462
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-(4-Bromo-3-methylphenyl)acetic acid

CAS No. 215949-57-8

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