2-Fluoro-4-methoxy-5-nitroaniline

CAS No. 1569986-91-9
Cat. No. CS-0144024
Purity≥98%
MDL No.MFCD29053562

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2-Fluoro-4-methoxy-5-nitroaniline|CS-0144024

Structure of 1569986-91-9

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Description

2-Fluoro-4-methoxy-5-nitroaniline features a trifunctional aromatic core with electron-withdrawing nitro and fluoro groups paired with an electron-donating methoxy group. This strategic electronic balance enables selective coupling in cross-coupling reactions and facilitates access to advanced intermediates for pharmaceutical and agrochemical development under standard conditions.

Application

2-Fluoro-4-methoxy-5-nitroaniline serves as a versatile building block in medicinal chemistry, enabling the synthesis of fluorinated heterocycles and bioactive scaffolds. Its orthogonal functional groups—fluorine, methoxy, and nitro—facilitate sequential transformations under standard conditions. The compound exhibits good bench stability and is compatible with palladium-catalyzed couplings, nucleophilic substitutions, and reduction protocols, making it well-suited for modular synthesis workflows in API development.

General Information

CAS No. 1569986-91-9
Cat. No. CS-0144024
Purity ≥98%
MDL No. MFCD29053562
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₇FN₂O₃
Molecular Weight 186.14
Synonym(s) None
SMILES NC1=CC([N+]([O-])=O)=C(OC)C=C1F

Computational Chemistry Data

TPSA 78.39
LogP 1.3247
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 2

Safety Information

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GHS Pictogram :	GHS No : GHS06
Signal Word : Danger	UN#: 2811
Class : 6.1	Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P280-P302+P352-P304+P340-P330-P361-P405-P501

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Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Nitro compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-Fluoro-4-methoxy-5-nitroaniline

CAS No. 1569986-91-9

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