4-Bromo-3-methyl-1,1'-biphenyl

Name: 4-Bromo-3-methyl-1,1'-biphenyl
Brand: ChemScene
Availability: InStock
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CAS No. 92022-07-6
Cat. No. CS-W000447
Purity≥98%
MDL No.MFCD00089406

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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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4-Bromo-3-methyl-1,1'-biphenyl|CS-W000447

Structure of 92022-07-6

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General Information

CAS No. 92022-07-6
Cat. No. CS-W000447
Purity ≥98%
MDL No. MFCD00089406
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₁Br
Molecular Weight 247.13
Synonym(s) 4-BROMO-3'-METHYLBIPHENYL
SMILES CC1=CC(C2=CC=CC=C2)=CC=C1Br

Description

4-Bromo-3-methyl-1,1'-biphenyl features a sterically hindered biphenyl core with complementary halogen and alkyl substituents. This configuration enables selective cross-coupling reactions under palladium catalysis, delivering functionalized biaryl architectures with high regiocontrol. The molecule exhibits robust stability under standard bench conditions and integrates efficiently into synthetic sequences requiring precise substitution patterns.

Application

4-Bromo-3-methyl-1,1'-biphenyl serves as a versatile building block in cross-coupling reactions, enabling efficient construction of biaryl scaffolds under palladium-catalyzed conditions. The bromo group facilitates reliable Suzuki, Stille, and Negishi couplings, while the methyl substituent provides steric and electronic modulation. Bench-stable and readily purified by column chromatography, it functions effectively in medicinal chemistry campaigns and materials synthesis.

Safety Information

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GHS Pictogram :	GHS No : GHS05,GHS07
Signal Word : Danger	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H318-H413
Precautionary Statements : P264-P270-P273-P280-P305+P351+P338-P330-P501

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Computational Chemistry Data

TPSA 0
LogP 4.42452
H_Acceptors 0
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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4-Bromo-3-methyl-1,1'-biphenyl

CAS No. 92022-07-6

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