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N-(2-Bromophenyl)methansulfonamide, an organosulfonamide derivative with the molecular formula C7H7BrNO2S, is a white powder that is insoluble in water but soluble in organic solvents. It belongs to the class of sulfonamides, which are commonly used as antibiotics and antifungal agents. The bromine atom attached to the phenyl ring endows the compound with unique chemical properties, making it a valuable building block in the field of medicinal chemistry for developing new drugs.

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  • 116547-91-2 Structure
  • Basic information

    1. Product Name: N-(2-Bromophenyl)methansulfonamide
    2. Synonyms: N-(2-Bromophenyl)methansulfonamide;Methanesulfonamide, N-(2-bromophenyl)-
    3. CAS NO:116547-91-2
    4. Molecular Formula: C7H8BrNO2S
    5. Molecular Weight: 250.11
    6. EINECS: N/A
    7. Product Categories: Aryl;Organohalides
    8. Mol File: 116547-91-2.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: N-(2-Bromophenyl)methansulfonamide(CAS DataBase Reference)
    10. NIST Chemistry Reference: N-(2-Bromophenyl)methansulfonamide(116547-91-2)
    11. EPA Substance Registry System: N-(2-Bromophenyl)methansulfonamide(116547-91-2)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 116547-91-2(Hazardous Substances Data)

116547-91-2 Usage

Uses

Used in Pharmaceutical Synthesis:
N-(2-Bromophenyl)methansulfonamide is used as a key intermediate in the synthesis of pharmaceuticals for its unique chemical properties and reactivity. It serves as a building block in the development of new drugs, particularly in the fields of antibiotics and antifungal agents.
Used in Agrochemical Synthesis:
In the agrochemical industry, N-(2-Bromophenyl)methansulfonamide is utilized as a precursor in the production of various agrochemicals. Its unique chemical properties make it suitable for the development of new compounds with potential applications in agriculture, such as pesticides and herbicides.
Used in Medicinal Chemistry Research:
N-(2-Bromophenyl)methansulfonamide is employed as a research tool in medicinal chemistry. Its unique chemical properties and reactivity make it a valuable compound for exploring new drug candidates and understanding the mechanisms of action in various diseases.
Used in Scientific and Industrial Applications:
Due to its unique chemical properties, N-(2-Bromophenyl)methansulfonamide has potential applications in various scientific and industrial fields. The bromine atom attached to the phenyl ring makes it useful for a wide range of applications, including the development of new materials, catalysts, and chemical processes.

Check Digit Verification of cas no

The CAS Registry Mumber 116547-91-2 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,6,5,4 and 7 respectively; the second part has 2 digits, 9 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 116547-91:
(8*1)+(7*1)+(6*6)+(5*5)+(4*4)+(3*7)+(2*9)+(1*1)=132
132 % 10 = 2
So 116547-91-2 is a valid CAS Registry Number.

116547-91-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name N-(2-bromophenyl)methanesulfonamide

1.2 Other means of identification

Product number -
Other names 2-bromo-1-methanesulfonylaminobenzene

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:116547-91-2 SDS

116547-91-2Relevant articles and documents

Synthesis of spiropyrrolidinyl-benzoisothiazoline derivatives by 1,3-dipolar cycloaddition of benzoisothiazole-2,2-dioxide-3-ylidenes and azomethine ylide

Cao, Guorui,Long, Feifei,Zhao, Yingchun,Wang, Yu,Huang, Longjiang,Teng, Dawei

, p. 9359 - 9365 (2014)

The new spirocyclic compounds, spiropyrrolidinyl-benzoisothiazoline derivatives were synthesized by the 1,3-dipolar cycloaddition of benzoisothiazole-2,2-dioxide-3-ylidenes and azomethine ylide. The stereochemistry of 1,3-dipolar cycloaddition as well as the stereochemistry of Knoevenagel condensation of benzoisothiazole-2,2-dioxide with aldehydes were studied.

CONDENSED-RING PYRIMIDYLAMINO DERIVATIVE, PREPARATION METHOD THEREFOR, AND INTERMEDIATE, PHARMACEUTICAL COMPOSITION AND APPLICATIONS THEREOF

-

Paragraph 0104; 0109, (2018/03/25)

Disclosed are a condensed-ring pyrimidylamino derivative, a preparation method therefor, and an intermediate, a pharmaceutical composition and applications thereof. The method for preparing the condensed-ring pyrimidylamino derivative comprises: in a solvent, in the presence of a palladium-containing catalyst, allowing a compound represented by formula I-a and a compound represented by formula I-b' to have a coupling reaction, and then preparing a compound represented by formula I by means of a deprotection reaction. Also disclosed applications of the condensed-ring pyrimidylamino derivative in the preparation of drugs for preventing, relieving and/or treating tumors or diseases caused by an anaplastic lymphoma kinase. The condensed-ring pyrimidylamino derivative of the present invention has an obvious restraint effect on the anaplastic lymphoma kinase.

FUSED RING PYRIMIDINE COMPOUND, INTERMEDIATE, AND PREPARATION METHOD, COMPOSITION AND USE THEREOF

-

Paragraph 0370-0371, (2018/08/12)

Disclosed area fused ring pyrimidine compound, and an intermediate, a preparation method, a composition and a use thereof. The fused ring pyrimidine compound is a compound as shown in formula I, a tautomer, an enantiomer, a diastereoisomer, a pharmaceutically acceptable salt, a metabolite, a metabolic precursor or a prodrug thereof, wherein the above-mentioned compound is used for the preparation of a medicine for preventing, remitting or treating one or more of immune system diseases, autoimmune diseases, cell proliferative diseases, allergic disorders and cardiovascular diseases, and the compound has a strong inhibitory effect on the Janues kinase, FGFR kinase, FLT3 kinase and Src family kinase.

Synthesis of Phenanthridines through Palladium-Catalyzed Cascade Reaction of 2-Halo-N-Ms-arylamines with Benzyl Halides/Sulfonates

Yang, Si-Yi,Han, Wen-Yong,Zhang, Ding-Lei,Zhou, Xiao-Jian,Bai, Mei,Cui, Bao-Dong,Wan, Nan-Wei,Yuan, Wei-Cheng,Chen, Yong-Zheng

, p. 996 - 1003 (2017/02/15)

An efficient palladium-catalyzed nucleophilic substitution/C–H activation/aromatization cascade reaction between readily available 2-halo-N-Ms-arylamines (Ms = methanesulfonyl) and benzyl halides/sulfonates has been described. A wide variety of phenanthridines were synthesized in a one-pot fashion in moderate to high yields (37–86 %). Notably, this method provides a straightforward, facile approach for the synthesis of phenanthridines. The practicality was further substantiated by successfully carrying out a gram-scale preparation.

Self-induced stereoselective in situ trifluoromethylation: Preparation of spiro[indoline-3,3′-quinoline] via palladium-catalyzed cascade reaction

Song, Hongjian,Liu, Yongxian,Liu, Yuxiu,Wang, Qingmin

supporting information, p. 3240 - 3243 (2014/07/08)

An efficient method to prepare 1′H-spiro[indoline-3,3′- quinoline]-2′,4′-diones and their trifluoromethylated products was developed via a palladium-catalyzed Sonogashira coupling/Wacker-type oxypalladation/cyclization cascade reaction. The amount of wate

Electron transfer activity of a cobalt crown carbene complex

Park, Stuart R.,Findlay, Neil J.,Garnier, Jean,Zhou, Shengze,Spicer, Mark D.,Murphy, John A.

supporting information; experimental part, p. 10756 - 10761 (2010/03/01)

The novel cobalt(II) crown carbene complex 12(II) has been prepared and characterised by X-ray crystallography. This complex is reduced in a one-electron process to a cobalt(I) complex that acts as a powerful single electron donor, reducing aryl halides,

Condensed Heteroaromatic Ring Systems. XIII. One-Step Synthesis of 2-Substituted 1-Methylsulfonylindoles from N-(2-Halophenyl)methanesulfonamides

Sakamoto, Takao,Kondo, Yoshinori,Iwashita, Shigeki,Nagano, Tatsuo,Yamanaka, Hiroshi

, p. 1305 - 1308 (2007/10/02)

The reaction of N-(2-bromophenyl)- and N-(2-iodophenyl)methanesulfonamide with terminal acetylenes in the presence of dichlorobis(triphenylphosphine)palladium yielded 1-methylsulfonylindoles having carbon-functional groups at the 2-position, such as hydroxymethyl, 2-hydroxyethyl, diethoxymethyl, 2-ethoxycarbonylethyl, etc., in one step.Keywords - palladium-catalyzed reaction; dichlorobis(triphenylphosphine)palladium; N-(2-halophenyl)methanesulfonamide; acetylene; 2-substituted 1-methylsulfonylindole.

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