2-(4-Bromo-2-methoxyphenyl)acetic acid

CAS No. 1026089-09-7
Cat. No. CS-W005525
Purity≥95%
MDL No.None

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Type	HazMat Fee
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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2-(4-Bromo-2-methoxyphenyl)acetic acid|CS-W005525

Structure of 1026089-09-7

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General Information

CAS No. 1026089-09-7
Cat. No. CS-W005525
Purity ≥95%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₉BrO₃
Molecular Weight 245.07
Synonym(s) None
SMILES COC1=C(CC(O)=O)C=CC(Br)=C1

Description

This brominated acetic acid derivative features a methoxy-substituted aryl ring, enabling integration into pharmaceutical intermediates and functional materials. The para-bromo and ortho-methoxy groups provide distinct electronic and steric profiles, enhancing reactivity in cross-coupling and derivatization processes under standard conditions.

Application

2-(4-Bromo-2-methoxyphenyl)acetic acid serves as a versatile building block in medicinal chemistry, enabling efficient access to brominated aromatic scaffolds via standard coupling reactions. Its pendant carboxylic acid facilitates direct amidation, esterification, or derivatization under mild conditions. The molecule exhibits good bench stability and compatibility with common functional groups, simplifying purification and integration into multi-step syntheses of bioactive compounds.

Synthesis

Route1
- In-stock
  
  858523-37-2
- ~88%
- In-stock
  
  1026089-09-7
References
- WO2008/55847 A1, ; Page/Page column 61 ; WO 2008/055847 A1
Route2
- 1261878-59-4
- ~78%
- In-stock
  
  1026089-09-7
References
- Journal of Medicinal Chemistry, , vol. 56, # 5 p. 1843 - 1852

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

Quality Control

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Computational Chemistry Data

TPSA 46.53
LogP 2.0848
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-(4-Bromo-2-methoxyphenyl)acetic acid

CAS No. 1026089-09-7

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