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Methyl 3-bromo-4-chlorobenzoate is a chemical compound with the molecular formula C8H6BrClO2, belonging to the group of Benzoic acids and derivatives. It is characterized by the presence of methyl, bromo, and chloro groups in its structure, which confer strong reactivity and make it essential in various chemical industries and reactions. Its physical properties, such as melting point, boiling point, and acidity or basicity, are highly influenced by its structural features. Methyl 3-bromo-4-chlorobenzoate is typically found in a crystalline form.

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  • 107947-17-1 Structure
  • Basic information

    1. Product Name: methyl 3-bromo-4-chlorobenzoate
    2. Synonyms: methyl 3-bromo-4-chlorobenzoate;3-Bromo-4-chlorobenzoic acid methyl ester;Benzoic acid, 3-broMo-4-chloro-, Methyl ester
    3. CAS NO:107947-17-1
    4. Molecular Formula: C8H6BrClO2
    5. Molecular Weight: 249.48904
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 107947-17-1.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 280℃
    3. Flash Point: 123℃
    4. Appearance: /
    5. Density: 1.604
    6. Refractive Index: N/A
    7. Storage Temp.: Room temperature.
    8. Solubility: N/A
    9. CAS DataBase Reference: methyl 3-bromo-4-chlorobenzoate(CAS DataBase Reference)
    10. NIST Chemistry Reference: methyl 3-bromo-4-chlorobenzoate(107947-17-1)
    11. EPA Substance Registry System: methyl 3-bromo-4-chlorobenzoate(107947-17-1)
  • 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: 107947-17-1(Hazardous Substances Data)

107947-17-1 Usage

Uses

Used in Chemical Synthesis:
Methyl 3-bromo-4-chlorobenzoate is used as a key intermediate in the synthesis of various organic compounds, including pharmaceuticals, agrochemicals, and specialty chemicals. Its reactivity and structural features make it a versatile building block for the development of new molecules with desired properties.
Used in Pharmaceutical Industry:
Methyl 3-bromo-4-chlorobenzoate is used as a starting material for the synthesis of various pharmaceutical compounds, particularly those with anti-inflammatory, analgesic, or antipyretic properties. Its unique structure allows for the development of new drugs with improved efficacy and reduced side effects.
Used in Agrochemical Industry:
Methyl 3-bromo-4-chlorobenzoate is used as a precursor in the production of agrochemicals, such as herbicides, insecticides, and fungicides. Its reactivity and structural features enable the creation of new compounds with enhanced pest control properties and reduced environmental impact.
Used in Specialty Chemicals:
Methyl 3-bromo-4-chlorobenzoate is used as a raw material in the production of specialty chemicals, such as dyes, pigments, and polymers. Its unique properties allow for the development of new materials with improved performance characteristics and applications in various industries, including textiles, plastics, and coatings.

Check Digit Verification of cas no

The CAS Registry Mumber 107947-17-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,0,7,9,4 and 7 respectively; the second part has 2 digits, 1 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 107947-17:
(8*1)+(7*0)+(6*7)+(5*9)+(4*4)+(3*7)+(2*1)+(1*7)=141
141 % 10 = 1
So 107947-17-1 is a valid CAS Registry Number.

107947-17-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name Methyl 3-bromo-4-chlorobenzoate

1.2 Other means of identification

Product number -
Other names 3-bromo-4-chloro-benzoic acid methyl ester

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:107947-17-1 SDS

107947-17-1Relevant articles and documents

Alkynyl-substituted heterocyclic compound, preparation method therefor and medical use therefor for effectively treating and/or preventing FGFR-related diseases such as tumors

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Page/Page column 59-60, (2020/02/18)

The present invention relates to an alkynyl-substituted heterocyclic compound serving as an FGFR inhibitor, a preparation method therefor and a medical use therefor. In particular, the present invention relates to a compound represented by the general formula (I) and its pharmaceutically acceptable salt, a pharmaceutical composition including the compound or its pharmaceutically acceptable salt, a method for treating and/or preventing FGFR-related diseases, particularly tumors, by using the compound or its pharmaceutically acceptable salt, and a preparation method of the compound or its pharmaceutically acceptable salt. The present invention also relates to an use of the compound or its pharmaceutically acceptable salt, or an pharmaceutical composition including the compound or its pharmaceutically acceptable salt in the preparation of a drug for treating and/or preventing FGFR-related diseases, particularly tumors, wherein the definition of each substituent in the general formula (I) is the same as that in the specification.

ALKYNYL-SUBSTITUTED HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF

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Paragraph 0220; 0221; 0222, (2019/07/23)

The present invention relates to an alkynyl-substituted heterocyclic compound acting as an FGFR inhibitor, a preparation method therefor and a medical use thereof. In particular, the present invention relates to a compound as shown in general formula (I) and a pharmaceutically acceptable salt thereof; a pharmaceutical composition including the compound or a pharmaceutically acceptable salt thereof; a method for treating and/or preventing FGFR-associated diseases, particularly tumors, by using the compound or a pharmaceutically acceptable salt thereof; and a preparation method for the compound or a pharmaceutically acceptable salt thereof. The present invention also relates to the use of the compound or a pharmaceutically acceptable salt thereof, or the pharmaceutical composition including the compound or a pharmaceutically acceptable salt thereof in the preparation of a drug for treating and/or preventing FGFR-associated diseases, particularly tumors, wherein the definition of each substituent group in general formula (I) is the same as that in the description.

Rhodium-Catalyzed Double Alkyl-Oxygen Bond Cleavage: An Alkyl Transfer Reaction from Bis/Tris(o-alkyloxyphenyl)phosphine to Aryl Acids

Zhou, Hui,Zhang, Jinlong,Yang, Huameng,Xia, Chungu,Jiang, Gaoxi

supporting information, p. 3406 - 3412 (2016/10/21)

An unprecedented rhodium-catalyzed selective cleavage of double alkyl-oxygen bonds of bis/tris(o-alkyloxyphenyl)phosphine has been realized, in which P atom functions as a directing group and simple aryl acids are the methyl group acceptor to provide methyl esters and a quaternary phosphonium salt. The preliminary mechanism was investigated via an 18O labeling experiment and stoichiometric reaction between a Rh-A crystal and an aromatic acid.

High-throughput virtual screening identifies novel N ′-(1- phenylethylidene)-benzohydrazides as potent, specific, and reversible LSD1 inhibitors

Sorna, Venkataswamy,Theisen, Emily R.,Stephens, Bret,Warner, Steven L.,Bearss, David J.,Vankayalapati, Hariprasad,Sharma, Sunil

, p. 9496 - 9508 (2014/01/06)

Lysine specific demethylase 1 (LSD1) plays an important role in regulating histone lysine methylation at residues K4 and K9 on histone H3 and is an attractive therapeutic target in multiple malignancies. Here we report a structure-based virtual screen of

SUBSTITUTED (E)-N'-(1-PHENYLETHYLIDENE) BENZOHYDRAZIDE ANALOGS AS HISTONE DEMETHYLASE INHIITORS

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Page/Page column 89, (2013/03/26)

In one aspect, the invention relates to substituted (E)-N'-(1- phenylethylidene)benzohydrazide analogs, derivatives thereof, and related compounds, which are useful as inhibitors of lysine-specific histone demethylase, including LSD1; synthetic methods fo

SUBSTITUTED BIPHENYL PHENOXY-, THIOPHENYL- AND AMINOPHENYLPROPANOIC ACID GPR40 MODULATORS

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Page/Page column 84-85, (2008/12/08)

The present invention provides compounds useful, for example, for treating metabolic disorders in a subject. Such compounds have the general formula (I) where the definitions of the variables are provided herein. The present invention also provides compositions that include, and methods for using, the compounds in preparing medicaments and for treating metabolic disorders such as, for example, type II diabetes.

GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO

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Page/Page column 85, (2008/12/04)

GnRH receptor antagonists are disclosed which have utility in the treatment of a variety of sex-hormone related conditions in both men and women. The compounds of this invention have the structure, wherein R1a, R1b, R1c, R1d, R2, R2a, and A are as defined herein, including stereoisomers, esters, solvates and pharmaceutically acceptable salts thereof. Also disclosed are compositions containing a compound of this invention in combination with a pharmaceutically acceptable carrier, as well as methods relating to the use thereof for antagonizing gonadotropin-releasing hormone in a subject in need thereof.

Discovery of potent and selective SH2 inhibitors of the tyrosine kinase ZAP-70

Vu, Chi B.,Corpuz, Evelyn G.,Merry, Taylor J.,Pradeepan, Selvaluxmi G.,Bartlett, Catherine,Bohacek, Regine S.,Botfield, Martyn C.,Eyermann, Charles J.,Lynch, Berkley A.,MacNeil, Ian A.,Ram, Mary K.,Van Schravendijk, Marie Rose,Violette, Shelia,Sawyer, Tomi K.

, p. 4088 - 4098 (2007/10/03)

A series of 1,2,4-oxadiazole analogues has been shown to be potent and selective SH2 inhibitors of the tyrosine kinase ZAP-70, a potential therapeutic target for immune suppression. These compounds typically are 200- 400-fold more potent than the native,

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