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METHYL 2-(4-FLUORO-3-NITROPHENYL)ACETATE is an organic compound that belongs to the class of phenylacetates. It is a clear, colorless liquid with a fruity odor. The presence of a nitro group and a fluorine atom in the molecule makes it useful in medicinal chemistry and as a building block in organic synthesis. Its unique chemical structure and properties make it a versatile compound for various industrial applications.

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  • 226888-37-5 Structure
  • Basic information

    1. Product Name: METHYL 2-(4-FLUORO-3-NITROPHENYL)ACETATE
    2. Synonyms: METHYL 2-(4-FLUORO-3-NITROPHENYL)ACETATE;Methyl (4-fluoro-3-nitrophenyl)acetate
    3. CAS NO:226888-37-5
    4. Molecular Formula: C9H8FNO4
    5. Molecular Weight: 213.16
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 226888-37-5.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.: Sealed in dry,Room Temperature
    8. Solubility: N/A
    9. CAS DataBase Reference: METHYL 2-(4-FLUORO-3-NITROPHENYL)ACETATE(CAS DataBase Reference)
    10. NIST Chemistry Reference: METHYL 2-(4-FLUORO-3-NITROPHENYL)ACETATE(226888-37-5)
    11. EPA Substance Registry System: METHYL 2-(4-FLUORO-3-NITROPHENYL)ACETATE(226888-37-5)
  • 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: 226888-37-5(Hazardous Substances Data)

226888-37-5 Usage

Uses

Used in Pharmaceutical Industry:
METHYL 2-(4-FLUORO-3-NITROPHENYL)ACETATE is used as an intermediate in the synthesis of various pharmaceuticals for its versatile chemical structure and properties.
Used in Agrochemical Industry:
METHYL 2-(4-FLUORO-3-NITROPHENYL)ACETATE is used in the synthesis of various agrochemicals, contributing to the development of effective and innovative products for agricultural applications.
Used in Fine Chemicals Production:
METHYL 2-(4-FLUORO-3-NITROPHENYL)ACETATE is used as an intermediate in the production of fine chemicals, playing a crucial role in creating high-quality specialty products.
Used in Research and Development:
METHYL 2-(4-FLUORO-3-NITROPHENYL)ACETATE is utilized in research and development settings to explore its potential applications and enhance the understanding of its chemical properties and behavior in various reactions.

Check Digit Verification of cas no

The CAS Registry Mumber 226888-37-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,2,6,8,8 and 8 respectively; the second part has 2 digits, 3 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 226888-37:
(8*2)+(7*2)+(6*6)+(5*8)+(4*8)+(3*8)+(2*3)+(1*7)=175
175 % 10 = 5
So 226888-37-5 is a valid CAS Registry Number.

226888-37-5SDS

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 (4-fluoro-3-nitrophenyl)acetate

1.2 Other means of identification

Product number -
Other names 4-fluoro-3-nitrophenylacetic 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:226888-37-5 SDS

226888-37-5Relevant articles and documents

Preparation method of 3-nitro-4-fluorophenylacetate

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Paragraph 0041-0045; 0056; 0061, (2020/02/27)

The invention discloses a method for preparing 3-nitro-4-fluorophenylacetate by using a microreactor, and belongs to the technical field of organic matter synthesis, the microreactor comprises precooling modules and a mixing module, and the method specifically comprises the following steps: (1) preparing raw materials: preparing a mixed solution of 4-fluorophenylacetate and concentrated sulfuric acid and a nitric acid solution; (2) pre-cooling: cooling the pre-cooling modules and the mixing module to a reaction temperature in advance, and then respectively adding the mixed solution of 4-fluorophenylacetate and concentrated sulfuric acid and the nitric acid solution into different pre-cooling modules; (3) mixing: after the raw materials are pre-cooled, adding the pre-cooled raw materials into the mixing module for mixing reaction; and (4) performing quenching and post-processing. The method provided by the invention can effectively control the heat release problem of the nitration reaction, and is high in safety; and the 3-nitro-4-fluorophenylacetate can be prepared with high selectivity, the conversion rate of the 4-fluorophenylacetate can reach 98.4%, and the selectivity can reach99: 1.

MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE

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, (2018/07/29)

Provided are IDO inhibitor compounds of Formula (I) and pharmaceutically acceptable salts thereof, their pharmaceutical compositions, their methods of preparation, and methods for their use in the prevention and/or treatment of diseases such as chronic viral infection, chronic bacterial infections, cancer, sepsis or a neurological disorder.

SUBSTITUTED HETEROCYCLIC ACETAMIDES AS KAPPA OPIOID RECEPTOR (KOR) AGONISTS

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, (2013/09/26)

The present invention relates to a series of substituted compounds having the general formula (I), including their ste reoisomers and/or their pharmaceutically acceptable salts, wherein R1, R2, R3. R4, R5, and R6 are as defined herein. This invention also relates to methods of making these compounds including intermediates. The compounds of this invention are effective at the kappa (κ) opioid receptor (KOR) site. Therefore, the compounds of this invention are useful as pharmaceutical agents, especially in the treatment and/or prevention of a variety of central nervous system disorders (CNS), including but not limited to acute and chronic pain, and associated disorders, particularly functioning peripherally at the CNS.

Design, synthesis, and biological activity of 5,10-dihydro-dibenzo[b,e][1, 4]diazepin-11-one-based potent and selective Chk-1 inhibitors

Wang, Le,Sullivan, Gerard M.,Hexamer, Laura A.,Hasvold, Lisa A.,Thalji, Reema,Przytulinska, Magdalena,Tao, Zhi-Fu,Li, Gaoquan,Chen, Zehan,Xiao, Zhan,Gu, Wen-Zhen,Xue, John,Bui, Mai-Ha,Merta, Philip,Kovar, Peter,Bouska, Jennifer J.,Zhang, Haiying,Park, Chang,Stewart, Kent D.,Sham, Hing L.,Sowin, Thomas J.,Rosenberg, Saul H.,Lin, Nan-Horng

, p. 4162 - 4176 (2008/02/13)

A novel series of 5,10-dihydro-dibenzo[b,e][1,4]diazepin-11-ones have been synthesized as potent and selective checkpoint kinase 1 (Chk1) inhibitors via structure-based design. Aided by protein X-ray crystallography, medicinal chemistry efforts led to the

NOVEL BENZIMIDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THESE COMPOUNDS

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Page 25, (2010/02/09)

The present invention relates to novel benzimidazole derivatives of the formula (I) as defined in the description and in the claims, pharmaceutical compositions containing these compounds, and methods of treatment therewith. The compounds of the invention are useful in the treatment of central nervous system diseases and disorders, which are responsive to modulation of the GABAA receptor complex, and in particular for inducing and maintaining anaesthesia, sedation and muscle relaxation, as well as for combating febrile convulsions in children. The compounds of the invention may also be used by veterinarians.

Isothiazole derivatives and their use as pesticides

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Page/Page column 42, (2010/11/29)

A compound of formula (I), where A is optionally substituted alkylene, alkenylene, alkynylene, cycloalkylene, alkylenoxy, oxy(C1-6)alkylene, alkylenethio, thio(C1-6)alkylene, C1-6alkylenamino, amino(C1-6)alkylene, [C1-6alkyleneoxy(C1-6)alkylene], [C1-6alkylenethio(c1-6)alkylene], [1-6alkylenesulfinyl(c1-6)alkylene], [c1-6alkylenesulfonyl(C1-6)alkylenc] or [C1-6alkyleneamino(C1-6)alkylene]; provided that A is not CH2 or CH2O; B is N, N-oxide or CR8; Y is O, S or NR9; Z is O, S or NR10; and R1, R2, R3, R4, R5, R6, R7, R8, R9, R10 are specified radicals; compositions containing them; processes for making them; and their use as insecticides or fungicides.

Synthetic studies towards western and eastern macropolypeptide subunits of Kistamycin

Beugelmans, Rene,Roussi, Georges,Zamora, Eduardo Gonzalez,Carbonnelle, Annie-Claude

, p. 5089 - 5112 (2007/10/03)

The western subunit (fused bicyclic 16+15 membered ring) was synthesized by sequential intramolecular S(N)Ar reaction and the first 17-membered ring compound as model of the eastern subunit was obtained by an intramolecular Ni0 mediated coupling reaction.

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