2-Amino-4-bromo-5-fluorophenol

Name: 2-Amino-4-bromo-5-fluorophenol
Brand: ChemScene
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CAS No. 1016234-89-1
Cat. No. CS-0079912
Purity≥96%
MDL No.MFCD11101429

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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-Amino-4-bromo-5-fluorophenol|CS-0079912

Structure of 1016234-89-1

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General Information

CAS No. 1016234-89-1
Cat. No. CS-0079912
Purity ≥96%
MDL No. MFCD11101429
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₅BrFNO
Molecular Weight 206.01
Synonym(s) 5-Bromo-4-fluoro-2-hydroxyaniline
SMILES OC1=CC(F)=C(Br)C=C1N

Description

2-Amino-4-bromo-5-fluorophenol features a strategically positioned amino group flanked by bromo and fluoro substituents, enabling direct functionalization in cross-coupling reactions. This electron-deficient scaffold integrates readily into bioactive scaffolds and advanced materials, offering high stability under standard conditions with predictable reactivity profiles.

Application

2-Amino-4-bromo-5-fluorophenol serves as a versatile building block in the synthesis of bioactive heterocycles and pharmaceutical intermediates. Its ortho-difunctionalized aromatic core enables efficient coupling reactions via palladium-catalyzed cross-coupling, while the amino group facilitates electrophilic substitution or derivatization. The molecule exhibits good bench stability and is readily purified by recrystallization, supporting its use in scalable medicinal chemistry campaigns.

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 : H302-H315-H319-H335
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 46.25
LogP 1.876
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 0

Other Classifications

Building Blocks Functional Group Phenol

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-Amino-4-bromo-5-fluorophenol

CAS No. 1016234-89-1

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