3'-Amino-4'-fluoroacetophenone

Name: 3'-Amino-4'-fluoroacetophenone
Brand: ChemScene
Availability: InStock
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CAS No. 2002-82-6
Cat. No. CS-W016284
Purity≥98%
MDL No.MFCD00115400

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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+
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3'-Amino-4'-fluoroacetophenone|CS-W016284

Structure of 2002-82-6

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General Information

CAS No. 2002-82-6
Cat. No. CS-W016284
Purity ≥98%
MDL No. MFCD00115400
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₈FNO
Molecular Weight 153.16
Synonym(s) 4-fluoro-3-amino-acetophenone
SMILES CC(C1=CC=C(F)C(N)=C1)=O

Description

3'-Amino-4'-fluoroacetophenone features a strategically positioned amino group and fluorine substituent that enhance electronic modulation and metabolic stability. This electron-deficient aryl ketone integrates readily into heterocyclic scaffolds and serves as a key intermediate in the synthesis of bioactive compounds, particularly in medicinal chemistry and agrochemical development.

Application

3'-Amino-4'-fluoroacetophenone serves as a versatile building block in medicinal chemistry, enabling direct incorporation into diverse heterocyclic scaffolds via condensation and cyclization reactions. Its amino and fluoro substituents provide orthogonal reactivity for sequential functionalization, while the ketone group facilitates imine formation and nucleophilic addition. Bench-stable and readily purified by recrystallization, it functions efficiently in standard coupling protocols and supports scalable synthesis of fluorinated aryl amide and amine derivatives.

Synthesis

Route1
- In-stock
  
  400-93-1
- ~95%
- In-stock
  
  2002-82-6
References
- Protiva, Miroslav; Jilek, Jiri; Rajsner, Miroslav; Sindelar, Karel; Bartl, Vaclav; et al. Collection of Czechoslovak Chemical Communications, 1987 , vol. 52, # 7 p. 1811 - 1833
Route2
- In-stock
  
  403-42-9
- ~%
- In-stock
  
  2002-82-6
References
- Bioorganic and Medicinal Chemistry Letters, , vol. 13, # 10 p. 1725 - 1728

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

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Computational Chemistry Data

TPSA 43.09
LogP 1.6105
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Ketone

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3'-Amino-4'-fluoroacetophenone

CAS No. 2002-82-6

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