4-Fluoro-2-Methoxy-5-Nitroaniline

Name: 4-Fluoro-2-Methoxy-5-Nitroaniline
Brand: ChemScene
Availability: InStock
Rating: 5 (1 reviews)

SDS

CAS No. 1075705-01-9
Cat. No. CS-B0928
Purity≥97%
MDL No.MFCD23098941

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HazMat Fee

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it. There is a HazMat shipping fee for each item that qualifies as a dangerous good, except in the following scenarios:

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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.

There is a HazMat shipping fee for each item that qualifies as a dangerous good. Please contact our quotation team via email to confirm the details.

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4-Fluoro-2-Methoxy-5-Nitroaniline|CS-B0928

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General Information

CAS No. 1075705-01-9
Cat. No. CS-B0928
Purity ≥97%
MDL No. MFCD23098941
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(F)C=C1OC

Description

4-Fluoro-2-methoxy-5-nitroaniline features a trifunctional aromatic core combining electron-withdrawing nitro and fluoro groups with a methoxy donor, enabling tailored reactivity in cross-coupling and heterocycle synthesis. This bench-stable derivative integrates readily into complex molecular architectures under standard conditions.

Application

4-Fluoro-2-methoxy-5-nitroaniline serves as a versatile building block in the synthesis of pharmaceutical intermediates and agrochemicals. Its electron-deficient aromatic core, combined with orthogonal functional groups—fluorine for metabolic stability, methoxy for synthetic handle, and nitro for reduction to amine—enables diverse transformations. The compound exhibits bench stability and facilitates efficient coupling reactions, making it well-suited for multi-step syntheses requiring selective reactivity and predictable transformation pathways.

Synthesis

Route1
- In-stock
  
  450-91-9
- ~76%
- In-stock
  
  1075705-01-9
References
- Ward, Richard A.; Anderton, Mark J.; Ashton, Susan; Bethel, Paul A.; Box, Matthew; Butterworth, Sam; Colclough, Nicola; Chorley, Christopher G.; Chuaqui, Claudio; Cross, Darren A.E.; Dakin, Les A.; Debreczeni, Judit E.; Eberlein, Cath; Finlay, M. Raymond V.; Hill, George B.; Grist, Matthew; Klinowska, Teresa C.M.; Lane, Clare; Martin, Scott; Orme, Jonathon P.; Smith, Peter; Wang, Fengjiang; Waring, Michael J. Journal of Medicinal Chemistry, 2013 , vol. 56, # 17 p. 7025 - 7048
Route2
- In-stock
  
  448-19-1
- ~%
- In-stock
  
  1075705-01-9
References
- ARIAD PHARMACEUTICALS, INC.; ZHU, Xiaotian; WANG, Yihan; SHAKESPEARE, William, C.; HUANG, Wei-Sheng; DALGARNO, David, C. Patent: WO2013/169401 A1, 2013 ;

Safety Information

Download SDS

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

Quality Control

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SDS
COA

Computational Chemistry Data

TPSA 78.39
LogP 1.3247
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 2

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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

Drug Discovery Cancer EGFR

Key Words

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