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1H-Indole, 3-iodo-1-[(4-methylphenyl)sulfonyl]is a chemical compound with the molecular formula C16H14INO2S. It is a derivative of indole, a heterocyclic compound that is commonly found in many natural products and pharmaceuticals. 1H-Indole, 3-iodo-1-[(4-methylphenyl)sulfonyl]is characterized by the presence of an iodine atom and a sulfonyl group attached to the indole ring. Its unique structural features and reactivity may offer potential applications in various fields such as organic synthesis, medicinal chemistry, and material science.

170456-80-1

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170456-80-1 Usage

Uses

Used in Organic Synthesis:
1H-Indole, 3-iodo-1-[(4-methylphenyl)sulfonyl]is used as a synthetic intermediate for the preparation of various organic compounds. Its reactivity and structural features make it a valuable building block in the synthesis of complex organic molecules.
Used in Medicinal Chemistry:
1H-Indole, 3-iodo-1-[(4-methylphenyl)sulfonyl]is used as a potential pharmaceutical candidate in medicinal chemistry. Its unique structure and properties may contribute to the development of new drugs with therapeutic applications.
Used in Material Science:
1H-Indole, 3-iodo-1-[(4-methylphenyl)sulfonyl]is used in material science for the development of new materials with specific properties. Its unique structural features may contribute to the creation of advanced materials with applications in various industries.
Note: The specific applications and industries for 1H-Indole, 3-iodo-1-[(4-methylphenyl)sulfonyl]may vary depending on the context and research. The provided uses are general examples based on the compound's properties and potential applications.

Check Digit Verification of cas no

The CAS Registry Mumber 170456-80-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,7,0,4,5 and 6 respectively; the second part has 2 digits, 8 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 170456-80:
(8*1)+(7*7)+(6*0)+(5*4)+(4*5)+(3*6)+(2*8)+(1*0)=131
131 % 10 = 1
So 170456-80-1 is a valid CAS Registry Number.

170456-80-1SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-iodo-1-tosyl-1-indole

1.2 Other means of identification

Product number -
Other names 3-iodo-1-tosylindole

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:170456-80-1 SDS

170456-80-1Relevant academic research and scientific papers

Selectively substituted thiophenes and indoles by a tandem palladium-catalyzed multicomponent reaction

Mitsudo, Koichi,Thansandote, Praew,Wilhelm, Thorsten,Mariampillai, Brian,Lautens, Mark

, p. 3939 - 3942 (2006)

A variety of di- and trisubstituted thiophenes were synthesized by a one-pot palladium-catalyzed ortho-alkylation sequence terminated by either Heck or C-H coupling. Initial results toward the functionalization of indoles are also presented.

A simple, two-step synthesis of 3-iodoindoles

Amjad, Muhammad,Knight, David W.

, p. 539 - 541 (2004)

2-Halo-anilines, protected as the corresponding sulfonamides or carbamates, can be converted very efficiently into 3-iodoindoles by sequential Sonogashira coupling with a 1-alkyne and 5-endo-dig iodocyclisation. Azaindoles can also be obtained using this methodology.

Cobalt-Catalyzed Hydroalkynylation of Vinylaziridines

Biletskyi, Bohdan,Kong, Lingyu,Tenaglia, Alphonse,Clavier, Hervé

supporting information, p. 2578 - 2585 (2021/03/18)

Transition metal-catalyzed hydroalkynylation reactions are efficient transformations allowing the straightforward formation of functionalized alkynes. Therein, we disclose the cobalt-catalyzed hydroalkynylation of vinylaziridines giving rise to both linea

Asymmetric Dearomatization of Indole by Palladium/PC-Phos-Catalyzed Dynamic Kinetic Transformation

Cheng, Jie,Chu, Haoke,Guo, Yin-Long,Yang, Junfeng,Zhang, Junliang

supporting information, p. 21991 - 21996 (2020/10/02)

A palladium-catalyzed intermolecular dynamic kinetic asymmetric dearomatization of 3-arylindoles with internal alkynes was developed with the use of achiral Xantphos and chiral sulfinamide phosphine ligand (PC-Phos) as the co-ligands. This method could deliver various spiro[indene-1,3′-indole] compounds in good yields (up to 95 % yield) with up to 98 % ee. The salient features of the transformation include the use of readily available substrates, ease of scale-up and the versatile functionalization of the products. The mechanistic experiments gave some insights on active intermediates.

Disulfide-Catalyzed Iodination of Electron-Rich Aromatic Compounds

Iida, Keisuke,Ishida, Shunsuke,Watanabe, Takamichi,Arai, Takayoshi

, (2019/06/13)

Herein, a disulfide-catalyzed electrophilic iodination of aromatic compounds using 1,3-diiodo-5,5-dimethylhydantoin (DIH) has been developed. The disulfide activates DIH as a Lewis base to promote the iodination reaction in acetonitrile under mild conditions. This system is applicable to a wide range of electron-rich aromatic compounds, including acetanilide, anisole, imidazole, and pyrazole derivatives.

Disulfide-Catalyzed Iodination of Electron-Rich Aromatic Compounds

Iida, Keisuke,Ishida, Shunsuke,Watanabe, Takamichi,Arai, Takayoshi

, p. 7411 - 7417 (2019/06/18)

Herein, a disulfide-catalyzed electrophilic iodination of aromatic compounds using 1,3-diiodo-5,5-dimethylhydantoin (DIH) has been developed. The disulfide activates DIH as a Lewis base to promote the iodination reaction in acetonitrile under mild conditions. This system is applicable to a wide range of electron-rich aromatic compounds, including acetanilide, anisole, imidazole, and pyrazole derivatives.

Enantioselective Synthesis of Cyclohepta[ b]indoles via Pd-Catalyzed Cyclopropane C(sp3)-H Activation as a Key Step

H?fner, Maximilian,Sokolenko, Yevhenii M.,Gamerdinger, Paul,Stempel, Erik,Gaich, Tanja

supporting information, p. 7370 - 7374 (2019/10/08)

An enantioselective synthesis of functionalized cyclohepta[b]indoles via Pd-catalyzed cyclopropane C-H activation followed by olefination and indole-vinylcyclopropane rearrangement is reported. The design of the chiral cyclopropane precursor was such that both enantiomeric cyclohepta[b]indoles were accessed from a single compound exhibiting a "hidden" symmetry plane. The scope of the method was demonstrated by varying the substituents on the cyclopropane as well as on the heterocycle itself.

H-bonding vs Protonation of Alkynes in Regioselective Hydroamination Reactions: A Glimpse into the Reactivity of Arylogous Ynolethers and Ynamines

Abe, Masahiro,Jean, Alexandre,Blanchet, Jér?me,Rouden, Jacques,Maddaluno, Jacques,De Paolis, Micha?l

, p. 15448 - 15475 (2019/11/29)

In this paper is described the competition and transition between hydrogen bonding and protonation of alkynes connected, on one side, to various aromatic rings and to chiral amino ester appendages on the other side. While the first mode of activation indu

Transition-Metal-Free Decarboxylative Iodination: New Routes for Decarboxylative Oxidative Cross-Couplings

Perry, Gregory J. P.,Quibell, Jacob M.,Panigrahi, Adyasha,Larrosa, Igor

supporting information, p. 11527 - 11536 (2017/08/30)

Constructing products of high synthetic value from inexpensive and abundant starting materials is of great importance. Aryl iodides are essential building blocks for the synthesis of functional molecules, and efficient methods for their synthesis from chemical feedstocks are highly sought after. Here we report a low-cost decarboxylative iodination that occurs simply from readily available benzoic acids and I2. The reaction is scalable and the scope and robustness of the reaction is thoroughly examined. Mechanistic studies suggest that this reaction does not proceed via a radical mechanism, which is in contrast to classical Hunsdiecker-type decarboxylative halogenations. In addition, DFT studies allow comparisons to be made between our procedure and current transition-metal-catalyzed decarboxylations. The utility of this procedure is demonstrated in its application to oxidative cross-couplings of aromatics via decarboxylative/C-H or double decarboxylative activations that use I2 as the terminal oxidant. This strategy allows the preparation of biaryls previously inaccessible via decarboxylative methods and holds other advantages over existing decarboxylative oxidative couplings, as stoichiometric transition metals are avoided.

Pyrimidine derivatives Anaplastic lymphoma kinase inhibitors

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Paragraph 0260-0262, (2017/07/23)

The invention belongs to the field of a medical technology and specifically relates to a pyrimidine derivative type anaplastic lymphoma kinase inhibitor as shown in the general formula (I) or its stereisomer, or its pharmaceutically acceptable salt, ester or solvate, wherein R1, R2, R3, R4, R5 and A ring are as defined in the specification. The invention also relates to a preparation method of the compounds, a pharmaceutic preparation and a pharmaceutical composition containing the compounds and an application of the compound or its stereisomer, or its pharmaceutically acceptable salt, ester or solvate in the preparation of medicines for treating and/or preventing diseases related to anaplastic lymphoma kinase-mediated cancer.

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