3,4-Dibromoisoquinoline

Name: 3,4-Dibromoisoquinoline
Brand: ChemScene
Availability: InStock
Rating: 5 (1 reviews)

CAS No. 36963-44-7
Cat. No. CS-0314844
Purity≥97%
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+

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

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Structure of 36963-44-7

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Description

3,4-Dibromoisoquinoline features two bromine atoms positioned at the 3 and 4 ring junctions of the isoquinoline scaffold, conferring enhanced electrophilicity and facilitating downstream functionalization. This electron-deficient heterocycle integrates readily into cross-coupling reactions and serves as a robust building block for bioactive molecules and advanced materials.

Application

3,4-Dibromoisoquinoline serves as a versatile building block in synthetic organic chemistry, enabling palladium-catalyzed cross-coupling reactions for the construction of biaryl and heteroaryl architectures. The dibromo substitution pattern provides orthogonal reactivity at both positions, facilitating sequential functionalization. Its stability under standard reaction conditions and compatibility with diverse coupling partners make it a practical choice for synthesizing complex pharmaceutical intermediates and advanced materials.

General Information

CAS No. 36963-44-7
Cat. No. CS-0314844
Purity ≥97%
MDL No. None
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₅Br₂N
Molecular Weight 286.95
Synonym(s) Inchi=1/C9H5br2N/C10-8-7-4-2-1-3-6(7)5-12-9(8)11/H1-5
SMILES C1=CC=C2C(=C1)C=NC(=C2Br)Br

Computational Chemistry Data

TPSA 12.89
LogP 3.7598
H_Acceptors 1
H_Donors 0
Rotatable_Bonds 0

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Isoquinoline compounds

Key Words

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3,4-Dibromoisoquinoline

CAS No. 36963-44-7

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