Lot numbers can be found on the outside label of a product:
2-Chloro-4,6-diphenyl-1,3,5-triazine
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CAS No. 3842-55-5
- Cat. No. CS-W010111
- Purity≥97%
- MDL No.MFCD05738885
*For research and further manufacturing use only, not for direct human use.
Structure of 3842-55-5
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General Information
- CAS No. 3842-55-5
- Cat. No. CS-W010111
- Purity ≥97%
- MDL No. MFCD05738885
- Storage -20°C
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₅H₁₀ClN₃
- Molecular Weight 267.72
- Synonym(s) 2-Chloro-4,6-diphenyl-S-triazine
- SMILES ClC1=NC(C2=CC=CC=C2)=NC(C3=CC=CC=C3)=N1
Description
2-Chloro-4,6-diphenyl-1,3,5-triazine features a highly reactive chlorine atom at the 2-position, enabling efficient coupling in cross-coupling and heterocycle synthesis. The electron-deficient triazine core, flanked by two bulky phenyl groups, enhances stability and directs regioselective functionalization. This bench-stable compound serves as a key scaffold for advanced materials and pharmaceutical intermediates.
Application
2-Chloro-4,6-diphenyl-1,3,5-triazine serves as a versatile building block in synthetic organic chemistry, enabling efficient construction of triazine-based scaffolds through nucleophilic substitution. The chlorine atom at the 2-position exhibits high reactivity toward amines and thiols, facilitating the assembly of functionalized heterocycles under mild conditions. Its diphenyl substitution enhances stability and solubility, supporting straightforward purification and scalability. This compound functions effectively in the synthesis of pharmaceutical intermediates and advanced materials, particularly where electron-deficient triazines are required.
Synthesis
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Route1
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108-77-0 -
In-stock
98-80-6 - ~73%
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In-stock
3842-55-5
References
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Idemitsu Kosan Co., Ltd. Patent: EP2415769 A1, 2012 ; Location in patent: Page/Page column 116-117 ;
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Route2
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108-86-1
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108-77-0
- ~61%
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In-stock
3842-55-5
References
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Zhong, Hongliang; Xu, Erjian; Zeng, Danli; Du, Junping; Sun, Jing; Ren, Shijie; Jiang, Biao; Fang, Qiang Organic Letters, 2008 , vol. 10, # 5 p. 709 - 712
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Route3
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108-77-0
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100-58-3
- ~80%
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In-stock
3842-55-5
References
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ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD.; KIM, Hyun; JUNG, So-Young; KIM, Chi-Sik; PARK, Kyoung-Jin; PARK, So-Mi; LEE, Kyung-Joo; KWON, Hyuck-Joo; KIM, Bong-Ok Patent: WO2014/3440 A1, 2014 ; Location in patent: Paragraph 161; 162; 163; 164 ;
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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 38.67
- LogP 3.859
- H_Acceptors 3
- H_Donors 0
- Rotatable_Bonds 2
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Key Words
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