1-Bromo-4-(trans-4-N-pentylcyclohexyl)benzene

Name: 1-Bromo-4-(trans-4-N-pentylcyclohexyl)benzene
Brand: ChemScene
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CAS No. 79832-89-6
Cat. No. CS-0152359
Purity≥98%
MDL No.MFCD00577359

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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-Bromo-4-(trans-4-N-pentylcyclohexyl)benzene|CS-0152359

Structure of 79832-89-6

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General Information

CAS No. 79832-89-6
Cat. No. CS-0152359
Purity ≥98%
MDL No. MFCD00577359
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₇H₂₅Br
Molecular Weight None
Synonym(s) benzene, 1-bromo-4-(trans-4-pentylcyclohexyl)-
SMILES CCCCC[C@H]1CC[C@@H](CC1)C2=CC=C(C=C2)Br

Description

1-Bromo-4-(trans-4-N-pentylcyclohexyl)benzene features a rigid trans-cyclohexyl spacer linked to a bromoaryl group, enabling precise spatial control in molecular design. The pentyl chain enhances solubility and phase behavior, while the bromine facilitates downstream cross-coupling reactions. This compound serves as a key building block for functionalized liquid crystal systems and advanced organic materials.

Application

1-Bromo-4-(trans-4-N-pentylcyclohexyl)benzene serves as a versatile building block for the synthesis of functionalized aromatic systems, enabling efficient Suzuki-Miyaura and Stille couplings. Its trans-configured cyclohexyl group provides defined stereochemical control, while the bromo substituent offers high reactivity under standard palladium-catalyzed conditions. The molecule exhibits excellent bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis in medicinal chemistry and materials science applications.

Safety Information

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GHS Pictogram :	GHS No : GHS05,GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H315-H318-H335-H413
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 0
LogP 6.3032
H_Acceptors 0
H_Donors 0
Rotatable_Bonds 5

Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Chiral compounds Chiral Building Blocks

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

79832-89-6 sigma79832-89-6 manufacturer79832-89-6 price79832-89-6 structure79832-89-6 SDSbuy 79832-89-679832-89-6 supplier79832-89-6 uses79832-89-6 molecular weightprice of 79832-89-679832-89-6 chemical name formula of 79832-89-6

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1-Bromo-4-(trans-4-N-pentylcyclohexyl)benzene

CAS No. 79832-89-6

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