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Methyl 3-(chlorosulfonyl)-4-methylbenzoate is a chemical compound with the molecular formula C9H9ClO4S. It is a derivative of benzoic acid, featuring a sulfonate group and a methyl group. This white crystalline solid is stable under normal conditions but may decompose under high temperatures or in the presence of strong acids or bases.

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  • 372198-41-9 Structure
  • Basic information

    1. Product Name: methyl 3-(chlorosulfonyl)-4-methylbenzoate
    2. Synonyms: methyl 3-(chlorosulfonyl)-4-methylbenzoate;3-(CHLOROSULFONYL)-4-METHYLBENZOIC ACID METHYL ESTER
    3. CAS NO:372198-41-9
    4. Molecular Formula: C9H9ClO4S
    5. Molecular Weight: 248.69
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 372198-41-9.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: methyl 3-(chlorosulfonyl)-4-methylbenzoate(CAS DataBase Reference)
    10. NIST Chemistry Reference: methyl 3-(chlorosulfonyl)-4-methylbenzoate(372198-41-9)
    11. EPA Substance Registry System: methyl 3-(chlorosulfonyl)-4-methylbenzoate(372198-41-9)
  • Safety Data

    1. Hazard Codes: Xn
    2. Statements: 22
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 372198-41-9(Hazardous Substances Data)

372198-41-9 Usage

Uses

Used in Pharmaceutical Industry:
Methyl 3-(chlorosulfonyl)-4-methylbenzoate is used as a building block for the synthesis of various pharmaceuticals. Its unique chemical structure allows it to be a key component in the development of new drugs, contributing to the advancement of medicine.
Used in Agrochemical Industry:
In the agrochemical industry, methyl 3-(chlorosulfonyl)-4-methylbenzoate is utilized as a precursor in the production of agrochemicals. Its properties make it suitable for the synthesis of compounds that can be used in crop protection and other agricultural applications.
Used in Dye Industry:
Methyl 3-(chlorosulfonyl)-4-methylbenzoate is employed as a building block in the synthesis of dyes. Its chemical structure contributes to the creation of a wide range of dyes with various properties, catering to different industries' needs.
Used in Organic Chemistry as a Reagent:
Methyl 3-(chlorosulfonyl)-4-methylbenzoate is used as a reagent in various organic chemistry reactions, such as esterifications and sulfonation reactions. Its versatility in these reactions makes it a valuable tool for chemists in research and development.

Check Digit Verification of cas no

The CAS Registry Mumber 372198-41-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 3,7,2,1,9 and 8 respectively; the second part has 2 digits, 4 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 372198-41:
(8*3)+(7*7)+(6*2)+(5*1)+(4*9)+(3*8)+(2*4)+(1*1)=159
159 % 10 = 9
So 372198-41-9 is a valid CAS Registry Number.

372198-41-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name methyl 3-chlorosulfonyl-4-methylbenzoate

1.2 Other means of identification

Product number -
Other names methyl 3-chlorosulphonyl-4-methyl-benzoate

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:372198-41-9 SDS

372198-41-9Relevant articles and documents

Synthesis, 3D-structure and stability analyses of NRPa-308, a new promising anti-cancer agent

Brachet, Etienne,Dumond, Aurore,Liu, Wang-Qing,Fabre, Marie,Selkti, Mohamed,Raynaud, Fran?oise,Hermine, Olivier,Benhida, Rachid,Belmont, Philippe,Garbay, Christiane,Lepelletier, Yves,Ronco, Cyril,Pagès, Gilles,Demange, Luc

supporting information, (2019/11/21)

We report herein the synthesis of a newly described anti-cancer agent, NRPa-308. This compound antagonizes Neuropilin-1, a multi-partners transmembrane receptor overexpressed in numerous tumors, and thereby validated as promising target in oncology. The p

Inhibitors of Neuropilin and use thereof for the treatment of Neuropilin-related diseases

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Paragraph 0119; 0120, (2015/02/02)

The present invention relates to a compound of general formula (I), and salts or solvate thereof, for treating a Neuropilin-related disease, disorder or condition; and to a composition, a pharmaceutical composition and a medicament comprising the compound of general formula (I).

INHIBITOR OF NEUROPILIN AND USE THEREOF FOR THE TREATMENT OF NEUROPILIN-RELATED DISEASES

-

Page/Page column 34, (2015/02/02)

The present invention relates to a compound of general formula (I), and salts or solvate thereof, for treating a Neuropilin-related disease, disorder or condition; and to a composition, a pharmaceutical composition and a medicament comprising the compound of general formula (I).

Novel pyrazolo[1,5-a]pyridines as p110α-selective PI3 kinase inhibitors: Exploring the benzenesulfonohydrazide SAR

Kendall, Jackie D.,Giddens, Anna C.,Tsang, Kit Yee,Frédérick, Rapha?l,Marshall, Elaine S.,Singh, Ripudaman,Lill, Claire L.,Lee, Woo-Jeong,Kolekar, Sharada,Chao, Mindy,Malik, Alisha,Yu, Shuqiao,Chaussade, Claire,Buchanan, Christina,Rewcastle, Gordon W.,Baguley, Bruce C.,Flanagan, Jack U.,Jamieson, Stephen M.F.,Denny, William A.,Shepherd, Peter R.

experimental part, p. 58 - 68 (2012/02/14)

Structure-activity relationship studies of the pyrazolo[1,5-a]pyridine class of PI3 kinase inhibitors show that substitution off the hydrazone nitrogen and replacement of the sulfonyl both gave a loss of p110α selectivity, with the exception of an N-hydroxyethyl analogue. Limited substitutions were tolerated around the phenyl ring; in particular the 2,5-substitution pattern was important for PI3 kinase activity. The N-hydroxyethyl compound also showed good inhibition of cell proliferation and inhibition of phosphorylation of Akt/PKB, a downstream marker of PI3 kinase activity. It had suitable pharmacokinetics for evaluation in vivo, and showed tumour growth inhibition in two human tumour cell lines in xenograft studies. This work has provided suggestions for the design of more soluble analogues.

PYRAZOLO[1,5-A]PYRIDINES AND THEIR USE IN CANCER THERAPY

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Page/Page column 76, (2009/03/07)

Pyrazolo[1,5-a]pyridines are described, including methods for their preparation, and their use as agents or drugs for cancer therapy, both alone or in combination with radiation and/or other anticancer drugs.

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