1-(4-Chlorobutyl)-4-fluorobenzene

Name: 1-(4-Chlorobutyl)-4-fluorobenzene
Brand: ChemScene
Availability: InStock
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CAS No. 54540-58-8
Cat. No. CS-0042392
Purity≥98%
MDL No.MFCD11935101

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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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1-(4-Chlorobutyl)-4-fluorobenzene|CS-0042392

Structure of 54540-58-8

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Description

1-(4-Chlorobutyl)-4-fluorobenzene features a fluorinated aromatic core paired with a linear chloroalkyl tether, enabling precise spatial control in synthetic transformations. This bifunctional scaffold integrates readily into polymer backbones and serves as a key intermediate for functionalized materials. The molecule exhibits enhanced stability under standard reaction conditions and facilitates efficient coupling reactions via the terminal chloride.

Application

1-(4-Chlorobutyl)-4-fluorobenzene serves as a versatile synthetic building block for constructing functionalized alkyl chains in medicinal chemistry and materials science. The terminal chloro group enables reliable SN2 displacement, while the fluorinated aryl core provides metabolic stability and enhanced lipophilicity. This compound exhibits excellent bench stability and compatibility with standard coupling reactions, facilitating efficient access to complex molecular architectures.

General Information

CAS No. 54540-58-8
Cat. No. CS-0042392
Purity ≥98%
MDL No. MFCD11935101
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₁₂ClF
Molecular Weight 186.65
Synonym(s) 4-chloro-1-bis-(p-fluorophenyl)butane
SMILES FC1=CC=C(CCCCCl)C=C1

Computational Chemistry Data

TPSA 0
LogP 3.3872
H_Acceptors 0
H_Donors 0
Rotatable_Bonds 4

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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Other Classifications

Building Blocks Functional Group Chloride

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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1-(4-Chlorobutyl)-4-fluorobenzene

CAS No. 54540-58-8

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