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CAS

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914635-58-8

4-bromo-2-(trifluoromethyl)phenetole, with the molecular formula C9H8BrF3O, is an aromatic ether characterized by the presence of a bromine atom and a trifluoromethyl group attached to a phenyl ring. This colorless liquid exhibits a slightly sweet odor and is widely recognized for its role as a building block in the synthesis of pharmaceutical and agrochemical compounds. Its potential biological activities, such as antibacterial and antifungal properties, have also been a subject of study.

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  • 914635-58-8 Structure

  • Basic information

    1. Product Name: 4-broMo-2-(trifluoroMethyl)phenetole
    2. Synonyms: 4-Ethoxy-3-(trifluoromethyl)bromobenzene;4-broMo-2-(trifluoroMethyl)phenetole;4-Bromo-1-ethoxy-2-(trifluoromethyl)benzene
    3. CAS NO:914635-58-8
    4. Molecular Formula: C9H8BrF3O
    5. Molecular Weight: 269.0584296
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 914635-58-8.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.: 2-8°C
    8. Solubility: N/A
    9. CAS DataBase Reference: 4-broMo-2-(trifluoroMethyl)phenetole(CAS DataBase Reference)
    10. NIST Chemistry Reference: 4-broMo-2-(trifluoroMethyl)phenetole(914635-58-8)
    11. EPA Substance Registry System: 4-broMo-2-(trifluoroMethyl)phenetole(914635-58-8)

  • 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: 914635-58-8(Hazardous Substances Data)

914635-58-8 Usage

Uses

Used in Pharmaceutical and Agrochemical Industries:
4-bromo-2-(trifluoromethyl)phenetole is utilized as a key intermediate in the synthesis of various pharmaceutical and agrochemical compounds. Its unique structure allows for the development of new drugs and pesticides with improved efficacy and selectivity.
Used in Organic Chemistry Research:
As an intermediate in organic chemistry, 4-bromo-2-(trifluoromethyl)phenetole is employed in the study and development of novel chemical reactions and processes. Its presence in research contributes to the advancement of organic chemistry and the discovery of new synthetic pathways.
Used in Biological Activity Studies:
4-bromo-2-(trifluoromethyl)phenetole is used as a subject of study for its potential antibacterial and antifungal properties. This research aims to explore its effectiveness in combating various microbial infections and contributes to the development of new antimicrobial agents.

Check Digit Verification of cas no

The CAS Registry Mumber 914635-58-8 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 9,1,4,6,3 and 5 respectively; the second part has 2 digits, 5 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 914635-58:
(8*9)+(7*1)+(6*4)+(5*6)+(4*3)+(3*5)+(2*5)+(1*8)=178
178 % 10 = 8
So 914635-58-8 is a valid CAS Registry Number.

914635-58-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-Bromo-1-ethoxy-2-(trifluoromethyl)benzene

1.2 Other means of identification

Product number -
Other names 4-bromo-1-ethoxy-2-trifluoromethylbenzene

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:914635-58-8 SDS

914635-58-8Relevant articles and documents

4-(3-Trifluoromethylphenyl)-pyrimidine-2-carbonitrile as cathepsin S inhibitors: N3, not N1 is critically important

Cai, Jiaqiang,Fradera, Xavier,Van Zeeland, Mario,Dempster, Maureen,Cameron, Kenneth S.,Bennett, D. Jonathan,Robinson, John,Popplestone, Lucy,Baugh, Mark,Westwood, Paul,Bruin, John,Hamilton, William,Kinghorn, Emma,Long, Clive,Uitdehaag, Joost C.M.

scheme or table, p. 4507 - 4510 (2010/10/21)

Using computer aided modelling studies, a new extended P2/S2 interaction was identified. This extended region can accommodate a variety of functional groups, such as aryls and basic amines. It was discovered that the N3 nitrogen of the pyrimidine-2-carbonitrile is critical for its cathepsin cysteine protease inhibition. N1 nitrogen also contributes to the inhibitory activity, but to a very limited degree. An 'in situ double activation' mechanism was proposed to explain these results.

6-PHENYL-1H-IMIDAZO[4, 5-C]PYRIDINE-4-CARBONITRILE DERIVATIVES AS CATHEPSIN K AND S INHIBITORS

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Page/Page column 14-15, (2010/11/28)

The present invention relates to 6-phenyl-1H-imidazo[4,5-c]pyridine-4-carbonitrile derivatives having the general Formula (I), to pharmaceutical compositions comprising the same as well as to the use of these derivatives for the preparation of a medicament for the treatment of cathepsin S and/or cathepsin K related diseases such as osteoporosis, atherosclerosis, inflammation and immune disorders, such as rheumatoid arthritis, and chronic pain, such as neuropathic pain.

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