Lot numbers can be found on the outside label of a product:
(4-Chloro-2-methylphenyl)methanamine
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CAS No. 27917-11-9
- Cat. No. CS-0450584
- Purity≥98%
- MDL No.None
*For research and further manufacturing use only, not for direct human use.
Structure of 27917-11-9
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General Information
- CAS No. 27917-11-9
- Cat. No. CS-0450584
- Purity ≥98%
- MDL No. None
- Storage 4°C, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₈H₁₀ClN
- Molecular Weight 155.62
- Synonym(s) 4-Chloro-2-methylbenzylamine
- SMILES CC1=CC(=CC=C1CN)Cl
Description
(4-Chloro-2-methylphenyl)methanamine features a benzylamine scaffold with ortho-methyl and para-chloro substituents, delivering enhanced electron density at the aromatic ring. This configuration supports efficient coupling reactions in medicinal chemistry scaffolds. The compound exhibits good solubility in common organic solvents and stability under standard bench conditions.
Application
(4-Chloro-2-methylphenyl)methanamine serves as a versatile building block for medicinal chemistry and agrochemical synthesis, enabling the construction of biologically active heterocycles and substituted anilines. Its ortho-methyl and para-chloro substituents provide enhanced metabolic stability and modulate electronic properties, while the primary amine facilitates straightforward derivatization via amidation, alkylation, or reductive amination. Bench-stable and readily purified by distillation or crystallization, it functions effectively in standard coupling protocols and transition-metal-catalyzed transformations.
Synthesis
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Route1
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In-stock
129716-11-6 - ~%
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In-stock
27917-11-9
References
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Leonard, Kristi; Marugan, Juan Jose; Raboisson, Pierre; Calvo, Raul; Gushue, Joan M.; Koblish, Holly K.; Lattanze, Jennifer; Zhao, Shuyuan; Cummings, Maxwell D.; Player, Mark R.; Maroney, Anna C.; Lu, Tianbao Bioorganic and Medicinal Chemistry Letters, 2006 , vol. 16, # 13 p. 3463 - 3468
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Route2
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In-stock
40137-29-9 - ~%
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In-stock
27917-11-9
References
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Leonard, Kristi; Marugan, Juan Jose; Raboisson, Pierre; Calvo, Raul; Gushue, Joan M.; Koblish, Holly K.; Lattanze, Jennifer; Zhao, Shuyuan; Cummings, Maxwell D.; Player, Mark R.; Maroney, Anna C.; Lu, Tianbao Bioorganic and Medicinal Chemistry Letters, 2006 , vol. 16, # 13 p. 3463 - 3468
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Route3
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900505-06-8 - ~%
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In-stock
27917-11-9
References
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Leonard, Kristi; Marugan, Juan Jose; Raboisson, Pierre; Calvo, Raul; Gushue, Joan M.; Koblish, Holly K.; Lattanze, Jennifer; Zhao, Shuyuan; Cummings, Maxwell D.; Player, Mark R.; Maroney, Anna C.; Lu, Tianbao Bioorganic and Medicinal Chemistry Letters, 2006 , vol. 16, # 13 p. 3463 - 3468
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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 : H315-H319-H335
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Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 26.02
- LogP 2.10712
- H_Acceptors 1
- H_Donors 1
- Rotatable_Bonds 1
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Key Words
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