Lot numbers can be found on the outside label of a product:
4-Methylbenzenesulfinamide
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CAS No. 6873-55-8
- Cat. No. CS-0153012
- Purity≥96%
- MDL No.MFCD02093698
*For research and further manufacturing use only, not for direct human use.
Structure of 6873-55-8
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General Information
- CAS No. 6873-55-8
- Cat. No. CS-0153012
- Purity ≥96%
- MDL No. MFCD02093698
- Storage 4°C, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₇H₉NOS
- Molecular Weight 155.22
- Synonym(s) N-(4-Methylphenyl)sulfinylamine
- SMILES CC1=CC=C(C=C1)S(=O)N
Description
4-Methylbenzenesulfinamide features a sulfinamide group attached to a methyl-substituted benzene ring, delivering enhanced stability and solubility in organic media. This compound serves as a key intermediate in the synthesis of bioactive molecules, particularly where controlled reactivity and selective functionalization are required. The para-methyl substitution imparts favorable electronic and steric properties for downstream transformations.
Application
4-Methylbenzenesulfinamide serves as a reliable sulfinamide source for asymmetric synthesis, enabling the formation of chiral sulfimines and subsequent transformations into enantioselective sulfonamides. Its bench-stable nature and compatibility with common functional groups facilitate straightforward purification and integration into multi-step sequences. This reagent functions effectively in transition-metal-catalyzed coupling reactions and acts as a versatile building block for heterocyclic scaffolds relevant to medicinal chemistry.
Synthesis
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Route1
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824-79-3 - ~84%
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In-stock
6873-55-8
References
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Savile, Christopher K.; Kazlauskas, Romas J. Advanced Synthesis and Catalysis, 2006 , vol. 348, # 10-11 p. 1183 - 1192
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Route2
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89244-06-4
- ~83%
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In-stock
6873-55-8
References
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Sato, Ryu; Saito, Nobushige; Takikawa, Yuji; Takizawa, Saburo; Saito, Minoru Synthesis, 1983 , # 12 p. 1045 - 1046
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Route3
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In-stock
103-19-5 - ~%
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In-stock
6873-55-8
References
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Garcia Ruano, Jose Luis; Aleman, Jose; Fajardo, Cristina; Parra, Alejandro Organic Letters, 2005 , vol. 7, # 24 p. 5493 - 5496
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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 43.09
- LogP 0.97632
- H_Acceptors 1
- H_Donors 1
- Rotatable_Bonds 1
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Key Words
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