α,α-Difluorobenzeneacetic acid

Name: α,α-Difluorobenzeneacetic acid
Brand: ChemScene
Availability: InStock
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CAS No. 360-03-2
Cat. No. CS-0020171
Purity≥98%
MDL No.MFCD00498146

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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α,α-Difluorobenzeneacetic acid|CS-0020171

Structure of 360-03-2

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Description

α,α-Difluorobenzeneacetic acid features a highly fluorinated benzylic carbon bearing two electronegative fluorine atoms, imparting enhanced metabolic stability and altered electronic properties. This structural motif enables direct incorporation into bioactive scaffolds where lipophilicity and resistance to oxidative degradation are critical. The molecule serves as a strategic building block for medicinal chemistry campaigns targeting CNS-active compounds and kinase inhibitors.

Application

α,α-Difluorobenzeneacetic acid serves as a valuable building block in medicinal chemistry, enabling the introduction of fluorinated alkyl groups into bioactive molecules. Its stability and compatibility with standard synthetic transformations facilitate efficient incorporation into pharmaceutical scaffolds. The geminal difluoro moiety imparts enhanced metabolic stability and modulates lipophilicity, making it particularly useful in optimizing drug-like properties.

General Information

CAS No. 360-03-2
Cat. No. CS-0020171
Purity ≥98%
MDL No. MFCD00498146
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₆F₂O₂
Molecular Weight 172.13
Synonym(s) 2,2-Difluoro-2-phenylacetic acid; Difluorophenylacetic acid; α,α-Difluorophenylacetic acid; DIFLUORO(PHENYL)ACETIC ACID
SMILES FC(C(O)=O)(F)C1=CC=CC=C1

Computational Chemistry Data

TPSA 37.3
LogP 1.863
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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352

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Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

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α,α-Difluorobenzeneacetic acid

CAS No. 360-03-2

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