Lot numbers can be found on the outside label of a product:
N-Allyl-4-methylbenzenesulfonamide
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CAS No. 50487-71-3
- Cat. No. CS-0179379
- Purity≥98%
- MDL No.None
*For research and further manufacturing use only, not for direct human use.
Structure of 50487-71-3
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General Information
- CAS No. 50487-71-3
- Cat. No. CS-0179379
- Purity ≥98%
- MDL No. None
- Storage 4°C
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₀H₁₃NO₂S
- Molecular Weight 211.28
- Synonym(s) N-Allyl-p-toluenesulfonaMide
- SMILES O=S(C1=CC=C(C)C=C1)(NCC=C)=O
Description
N-Allyl-4-methylbenzenesulfonamide features a sulfonamide group linked to a para-methyl-substituted benzene ring and an allyl moiety at nitrogen. This combination imparts stability and reactivity suitable for cross-coupling processes, enabling efficient incorporation into complex molecular architectures under mild conditions.
Application
N-Allyl-4-methylbenzenesulfonamide serves as a versatile sulfonamide building block in synthetic organic chemistry, enabling efficient access to functionalized heterocycles and amine derivatives. Its allyl group facilitates subsequent transformations such as cycloadditions, metal-catalyzed couplings, and dihydroxylation reactions. The sulfonamide moiety provides excellent stability, solubility, and orthogonal reactivity, while the para-methyl substituent enhances electronic tuning and crystallinity. This compound functions reliably in multistep syntheses, offering predictable reactivity and straightforward purification—ideal for medicinal chemistry and process development workflows.
Synthesis
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Route1
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In-stock
55022-46-3 - ~92%
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In-stock
50487-71-3
References
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Yan, Mei; Jin, Tienan; Ishikawa, Yoshifumi; Fujita, Takeshi; Chen, Lu-Yang; Asao, Naoki; Chen, Ming-Wei; Yamamoto, Yoshinori; Minato, Taketoshi; Bao, Ming Journal of the American Chemical Society, 2012 , vol. 134, # 42 p. 17536 - 17542,7
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Route2
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In-stock
24057-28-1 -
107-11-9 - ~93%
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In-stock
50487-71-3
References
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Caddick, Stephen; Wilden, Jonathan D.; Judd, Duncan B. Journal of the American Chemical Society, 2004 , vol. 126, # 4 p. 1024 - 1025
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Route3
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107-11-9
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7466-04-8 - ~92%
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In-stock
50487-71-3
References
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Wilden, Jonathan D.; Geldeard, Lynsey; Lee, Chieh C.; Judd, Duncan B.; Caddick, Stephen Chemical Communications, 2007 , # 10 p. 1074 - 1076
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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
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Precautionary Statements : P264-P280-P302+P352-P362
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Quality Control
Computational Chemistry Data
- TPSA 46.17
- LogP 1.45932
- H_Acceptors 2
- H_Donors 1
- Rotatable_Bonds 4
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Key Words
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