Lot numbers can be found on the outside label of a product:
4-Fluoro-5-methylbenzene-1,2-diamine
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CAS No. 97389-11-2
- Cat. No. CS-0153291
- Purity≥98%
- MDL No.MFCD17167315
*For research and further manufacturing use only, not for direct human use.
Structure of 97389-11-2
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General Information
- CAS No. 97389-11-2
- Cat. No. CS-0153291
- Purity ≥98%
- MDL No. MFCD17167315
- Storage 4°C, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₇H₉FN₂
- Molecular Weight None
- Synonym(s) 4-Fluoro-5-methyl-1,2-benzenediamine
- SMILES CC1=CC(=C(C=C1F)N)N
Description
4-Fluoro-5-methylbenzene-1,2-diamine features a fluorinated aromatic core with strategically positioned amino and methyl groups, enabling precise tuning of electronic properties. This electron-rich scaffold integrates readily into complex molecular architectures, offering enhanced reactivity in transition-metal-catalyzed coupling processes. The ortho-diamine motif facilitates chelation in coordination chemistry, while the para-fluorine enhances metabolic stability and membrane permeability.
Application
4-Fluoro-5-methylbenzene-1,2-diamine serves as a valuable building block for heterocyclic synthesis, particularly in the construction of substituted quinazolines and other nitrogen-containing scaffolds. Its ortho-diamine functionality enables efficient cyclization reactions, while the fluorine and methyl substituents provide tunable electronic and steric properties. The compound exhibits good bench stability and is compatible with standard purification methods, facilitating its use in medicinal chemistry campaigns and process development workflows.
Synthesis
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Route1
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97389-10-1 - ~94%
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In-stock
97389-11-2
References
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Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry, , vol. 39, # 3 p. 213 - 218
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Route2
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In-stock
452-69-7 - ~%
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In-stock
97389-11-2
References
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Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry, , vol. 39, # 3 p. 213 - 218
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Route3
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331-30-6 - ~%
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In-stock
97389-11-2
References
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Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry, , vol. 39, # 3 p. 213 - 218
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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 52.04
- LogP 1.29852
- H_Acceptors 2
- H_Donors 2
- Rotatable_Bonds 0
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Key Words
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