Lot numbers can be found on the outside label of a product:
3-Chloro-4-((3-fluorobenzyl)oxy)aniline
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CAS No. 202197-26-0
- Cat. No. CS-0008658
- Purity≥98%
- MDL No.MFCD06809822
*For research and further manufacturing use only, not for direct human use.
Structure of 202197-26-0
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General Information
- CAS No. 202197-26-0
- Cat. No. CS-0008658
- Purity ≥98%
- MDL No. MFCD06809822
- Storage RT, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₃H₁₁ClFNO
- Molecular Weight 251.68
- Synonym(s) 4-(3-fluorobenzyloxy)-3-chlorobenzenamine
- SMILES NC1=CC=C(OCC2=CC=CC(F)=C2)C(Cl)=C1
Description
3-Chloro-4-((3-fluorobenzyl)oxy)aniline features a fluorinated benzyl ether moiety paired with a chloro-substituted aniline core, enabling enhanced metabolic stability and targeted electronic modulation. This scaffold integrates well into kinase inhibitor architectures and offers favorable solubility for solution-phase synthesis.
Application
3-Chloro-4-((3-fluorobenzyl)oxy)aniline serves as a versatile building block for pharmaceutical intermediates, enabling efficient construction of heterocyclic scaffolds via standard coupling and cyclization protocols. The ortho-chloro and fluorobenzyl ether functionalities provide enhanced reactivity and metabolic stability, while the aniline core supports facile derivatization under mild conditions. Bench-stable and readily purified by chromatography or crystallization, it functions reliably in multi-step synthesis workflows.
Synthesis
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Route1
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In-stock
443882-99-3 - ~99%
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In-stock
202197-26-0
References
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Lackey, Karen Elizabeth; Spector, Neil; Wood lll, Edgar Raymond; Xia, Wenle Patent: US2004/53946 A1, 2004 ;
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Route2
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878018-19-0 - ~92%
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In-stock
202197-26-0
References
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BAYER HEALTHCARE AG Patent: US2010/298297 A1, 2010 ; Location in patent: Page/Page column 14 ;
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Route3
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In-stock
619-08-9 - ~%
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In-stock
202197-26-0
References
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Bioorganic and Medicinal Chemistry Letters, , vol. 16, # 17 p. 4686 - 4691
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H315-H319-H335
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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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Quality Control
Computational Chemistry Data
- TPSA 35.25
- LogP 3.6403
- H_Acceptors 2
- H_Donors 1
- Rotatable_Bonds 3
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Key Words
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