2-bromo-1,3-diisopropylbenzene

Name: 2-bromo-1,3-diisopropylbenzene
Brand: ChemScene
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CAS No. 57190-17-7
Cat. No. CS-W004639
Purity≥97%
MDL No.MFCD16876782

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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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2-bromo-1,3-diisopropylbenzene|CS-W004639

Structure of 57190-17-7

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Description

2-Bromo-1,3-diisopropylbenzene features a sterically hindered aromatic core with bromine at the 2-position, enabling selective cross-coupling reactions. The diisopropyl substitution enhances solubility and stability under standard conditions, while the electron-deficient aryl halide facilitates efficient palladium-catalyzed transformations. This bench-stable reagent integrates seamlessly into complex molecule assembly workflows.

Application

2-Bromo-1,3-diisopropylbenzene serves as a versatile aryl halide building block in cross-coupling reactions, enabling efficient C–C bond formation under palladium-catalyzed conditions. The diisopropyl substitution provides steric bulk that enhances stability and facilitates purification, while the bromine moiety offers high reactivity in Suzuki, Stille, and Negishi couplings. Its bench-stable nature and compatibility with diverse functional groups make it ideal for synthesizing complex pharmaceutical intermediates and functionalized arenes.

General Information

CAS No. 57190-17-7
Cat. No. CS-W004639
Purity ≥97%
MDL No. MFCD16876782
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₇Br
Molecular Weight 241.17
Synonym(s) 1,3-diisopropyl-2-brombenzene
SMILES CC(C)c1cccc(C(C)C)c1Br

Computational Chemistry Data

TPSA 0
LogP 4.6959
H_Acceptors 0
H_Donors 0
Rotatable_Bonds 2

Safety Information

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GHS Pictogram :	GHS No : GHS07,GHS09
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H410
Precautionary Statements : P264-P270-P273-P391-P501

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Other Classifications

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-bromo-1,3-diisopropylbenzene

CAS No. 57190-17-7

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