1018678-48-2 | 2-Difluoromethyl-benzoic acid methyl ester

Packsize	Purity	Availability	Price	Discounted Price
1g	97%	in stock	$114.00	$80.00
5g	97%	in stock	$387.00	$271.00
25g	97%	in stock	$1,078.00	$755.00

Description

• Catalog Number: AA07291
• Chemical Name: 2-Difluoromethyl-benzoic acid methyl ester
• CAS Number: 1018678-48-2
• Molecular Formula: C9H8F2O2
• Molecular Weight: 186.1554
• MDL Number: MFCD16140192
• SMILES: COC(=O)c1ccccc1C(F)F

Computed Properties

• Complexity: 183
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• XLogP3: 3

Upstream Synthesis Route

2-Difluoromethyl-benzoic acid methyl ester is a versatile compound widely used in chemical synthesis for its unique properties and applications. This compound serves as a valuable building block in the production of various organic compounds due to its distinctive difluoromethyl group, which can impart specific characteristics to the final products.In organic synthesis, 2-Difluoromethyl-benzoic acid methyl ester can be employed to introduce the difluoromethyl moiety into target molecules, enhancing their bioactivity, stability, or other desired properties. The presence of the difluoromethyl group can also influence the reactivity and selectivity of chemical reactions, leading to the formation of structurally diverse and complex molecules.Additionally, this compound is utilized in medicinal chemistry for the development of pharmaceuticals and agrochemicals. By incorporating the difluoromethyl-benzoic acid methyl ester moiety into drug candidates or crop protection agents, researchers can modulate their interactions with biological targets, potentially improving efficacy and reducing off-target effects.Overall, the application of 2-Difluoromethyl-benzoic acid methyl ester in chemical synthesis offers a valuable tool for the design and preparation of novel compounds with tailored properties and functionalities.