3-Bromo-4-fluorophenylamine

Name: 3-Bromo-4-fluorophenylamine
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CAS No. 656-64-4
Cat. No. CS-W008702
Purity≥98%
MDL No.MFCD03788559

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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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Structure of 656-64-4

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Description

N-Succinimidyl 3-(propargyloxy)propionate is an acetylene-containing reagent with NHS ester functionality for reaction with amines.

Application

3-Bromo-4-fluorophenylamine serves as a versatile building block in medicinal chemistry, enabling palladium-catalyzed cross-coupling reactions due to its orthogonal halogen reactivity. The bromo group facilitates Suzuki, Stille, and Negishi couplings, while the fluoro substituent enhances metabolic stability and modulates electronic properties. Its bench-stable solid form simplifies handling and purification, making it ideal for constructing complex heterocyclic scaffolds and API intermediates.

General Information

CAS No. 656-64-4
Cat. No. CS-W008702
Purity ≥98%
MDL No. MFCD03788559
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₅BrFN
Molecular Weight 190.01
Synonym(s) Aniline, 3-bromo-4-fluoro- (6CI,7CI,8CI); 3-Bromo-4-fluoroaniline; 3-Bromo-4-fluorobenzenamine; 3-Bromo-4-Fluoro Aniline
SMILES FC1=CC=C(N)C=C1Br

Computational Chemistry Data

TPSA 26.02
LogP 2.1704
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 0

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS06
Signal Word : Danger	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P301+P310-P302+P352-P304+P340-P311-P312-P330-P361-P363-P403+P233-P405-P501

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Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-Bromo-4-fluorophenylamine

CAS No. 656-64-4

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