4-Bromo-1,1-difluorocyclohexane

Name: 4-Bromo-1,1-difluorocyclohexane
Brand: ChemScene
Availability: InStock
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CAS No. 1196156-51-0
Cat. No. CS-0051024
Purity≥98%
MDL No.None

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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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*For research and further manufacturing use only, not for direct human use.

4-Bromo-1,1-difluorocyclohexane|CS-0051024

Structure of 1196156-51-0

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Description

4-Bromo-1,1-difluorocyclohexane features a cyclohexane ring with strategic fluorine and bromine substituents at adjacent positions, enabling selective functionalization in synthetic workflows. The 1,1-difluoro motif imparts enhanced metabolic stability and lipophilicity, while the C–Br bond facilitates palladium-catalyzed cross-coupling reactions. This compound serves as a key intermediate for bioactive molecule synthesis.

Application

4-Bromo-1,1-difluorocyclohexane serves as a versatile building block in medicinal chemistry and synthetic organic chemistry, enabling the introduction of both bromine and difluoromethylene motifs into complex molecular architectures. Its bench-stable nature and compatibility with palladium-catalyzed cross-coupling reactions facilitate efficient C–C bond formation. The 1,1-difluoro substitution enhances metabolic stability and modulates lipophilicity, while the bromine handle allows for diverse downstream functionalization, making it a practical reagent for scaffold diversification in API development.

General Information

CAS No. 1196156-51-0
Cat. No. CS-0051024
Purity ≥98%
MDL No. None
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₉BrF₂
Molecular Weight 199.04
Synonym(s) None
SMILES FC1(F)CCC(Br)CC1

Computational Chemistry Data

TPSA 0
LogP 2.9592
H_Acceptors 0
H_Donors 0
Rotatable_Bonds 0

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H227-H315-H319-H335
Precautionary Statements : P210-P261-P264-P271-P280-P302+P352-P304+P340-P362-P370+P378-P405-P501

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Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Fatty ring compounds Cyclohexane compounds

Key Words

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4-Bromo-1,1-difluorocyclohexane

CAS No. 1196156-51-0

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