1000566-45-9 | 4-Methoxy-3-(trifluoromethyl)phenylacetic acid

Packsize	Purity	Availability	Price	Discounted Price
250mg	97%	in stock	$50.00	$35.00
1g	97%	in stock	$105.00	$73.00
5g	97%	in stock	$290.00	$203.00

Description

• Catalog Number: AA00741
• Chemical Name: 4-Methoxy-3-(trifluoromethyl)phenylacetic acid
• CAS Number: 1000566-45-9
• Molecular Formula: C10H9F3O3
• Molecular Weight: 234.1719
• MDL Number: MFCD09832302
• SMILES: COc1ccc(cc1C(F)(F)F)CC(=O)O

Computed Properties

• Complexity: 252
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 6
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 2.2

Upstream Synthesis Route

The 2-(4-Methoxy-3-(trifluoromethyl)phenyl)acetic acid plays a crucial role in chemical synthesis as a versatile building block. It exhibits unique properties that make it highly desirable for various synthetic applications. The presence of the methoxy and trifluoromethyl groups imparts distinct reactivity, allowing for strategic incorporation into complex molecular structures. In organic synthesis, this compound serves as a valuable starting material for the preparation of pharmaceuticals, agrochemicals, and advanced materials. Its functional groups can participate in a range of transformations such as Suzuki coupling, esterification, amidation, and oxidation reactions. Additionally, the trifluoromethyl moiety enhances the compound's lipophilicity, potentially influencing its bioavailability and pharmacological properties. This compound's synthetic utility extends to the construction of heterocycles, organometallic complexes, and chiral compounds. Overall, the 2-(4-Methoxy-3-(trifluoromethyl)phenyl)acetic acid is a valuable tool for chemists seeking to design and construct novel molecules with specific properties and functionalities.