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3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine is a pyridine derivative with the molecular formula C6H3BrF3NO. It features a hydroxy group at the 2nd position, a trifluoromethyl group at the 5th position, and a bromine atom at the 3rd position. This chemical compound is widely used in organic synthesis and medicinal chemistry as a key building block for the development of pharmaceutical and agrochemical compounds. Its unique chemical structure and potential biological activities, such as anti-inflammatory and anticancer properties, make it a valuable compound for researchers in the fields of chemistry and drug discovery.

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  • 76041-73-1 Structure
  • Basic information

    1. Product Name: 3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine
    2. Synonyms: 3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine;3-Bromo-5-(trifluoromethyl)pyridin-2-ol;3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine 98%;3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine98%;3-bromo-5-(trifluoromethyl)pyridine-2-ol;3-Bromo-5-(trifluoromethyl)pyridin-2-ol, 5-Bromo-6-hydroxy-alpha,alpha,alpha-trifluoro-3-picoline;3-Bromo-5-(Trifluoromethyl)pyridin-2-ylol
    3. CAS NO:76041-73-1
    4. Molecular Formula: C6H3BrF3NO
    5. Molecular Weight: 241.9933296
    6. EINECS: N/A
    7. Product Categories: blocks;Bromides;Pyridines
    8. Mol File: 76041-73-1.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 252.7 °C at 760 mmHg
    3. Flash Point: 106.6 °C
    4. Appearance: White to yellow/Crystalline Powder
    5. Density: 1.876 g/cm3
    6. Refractive Index: N/A
    7. Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
    8. Solubility: N/A
    9. PKA: 8.06±0.10(Predicted)
    10. CAS DataBase Reference: 3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine(CAS DataBase Reference)
    11. NIST Chemistry Reference: 3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine(76041-73-1)
    12. EPA Substance Registry System: 3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine(76041-73-1)
  • Safety Data

    1. Hazard Codes: Xi,T
    2. Statements: 25
    3. Safety Statements: 45
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: IRRITANT
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 76041-73-1(Hazardous Substances Data)

76041-73-1 Usage

Uses

Used in Organic Synthesis:
3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine is used as a building block in organic synthesis for the creation of various complex organic molecules. Its unique functional groups allow for versatile chemical reactions, making it a valuable intermediate in the synthesis of pharmaceutical and agrochemical compounds.
Used in Medicinal Chemistry:
In the field of medicinal chemistry, 3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine is employed as a key component in the development of new drugs. Its presence in the molecular structure can impart specific biological activities, such as anti-inflammatory and anticancer properties, which are essential for the treatment of various diseases.
Used in Drug Discovery:
3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine is utilized in drug discovery research to identify and optimize potential drug candidates. Its unique chemical structure and functional groups make it an attractive starting point for the design and synthesis of novel therapeutic agents with improved efficacy and selectivity.
Used in Agrochemical Development:
In the agrochemical industry, 3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine is used as a building block for the synthesis of various agrochemical compounds, such as pesticides and herbicides. Its unique properties can contribute to the development of more effective and environmentally friendly agrochemicals.
Used in Biological Activity Research:
3-Bromo-2-hydroxy-5-(trifluoromethyl)pyridine is studied for its potential biological activities, including its anti-inflammatory and anticancer properties. Researchers are interested in understanding the compound's mechanism of action and exploring its potential as a therapeutic agent for various diseases.

Check Digit Verification of cas no

The CAS Registry Mumber 76041-73-1 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,6,0,4 and 1 respectively; the second part has 2 digits, 7 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 76041-73:
(7*7)+(6*6)+(5*0)+(4*4)+(3*1)+(2*7)+(1*3)=121
121 % 10 = 1
So 76041-73-1 is a valid CAS Registry Number.

76041-73-1 Well-known Company Product Price

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  • Aldrich

  • (L510572)  3-Bromo-2-hydroxy-5-trifluoromethylpyridine  AldrichCPR

  • 76041-73-1

  • L510572-1G

  • 514.80CNY

  • Detail

76041-73-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-Bromo-2-hydroxy-5-trifluoromethylpyridine

1.2 Other means of identification

Product number -
Other names 3-bromo-5-(trifluoromethyl)-1H-pyridin-2-one

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:76041-73-1 SDS

76041-73-1Relevant articles and documents

COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS

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Paragraph 00377, (2016/04/20)

The present invention provides compounds of Formula (I) and (II) as described herein, and salts thereof, and therapeutic uses of these compounds for treatment of disorders associated with Raf kinase activity. The invention further provides pharmaceutical compositions comprising these compounds, and compositions comprising these compounds and a therapeutic co-agent.

Heterocyclic cyclopentyl tetrahydroisoquinoline and tetrahydropyridopyridine modulators of chemokine receptor activity

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Page/Page column 25, (2008/06/13)

The present invention is directed to compounds of the formula I: Wherein R1, R2, R3, R4, R5, R6, R7, R8, R9, X, n and the broken lines are as defined herein which are useful as modulators of chemokine receptor activity. In particular, these compounds are useful as modulators of the chemokine receptor CCR-2.

HETEROCYCLIC DERIVATIVES AS CETP INHIBITORS

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Page/Page column 44-45, (2008/12/05)

The present invention provides a compound of formula (I), said compound is an inhibitor of CETP, and thus can be employed for the treatment of a disorder or disease mediated by CETP or responsive to the inhibition of CETP.

ORGANIC COMPOUNDS

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Page/Page column 43-44, (2008/12/05)

The present invention provides a compound of formula (I), said compound is an inhibitor of CETP, and thus can be employed for the treatment of a disorder or disease mediated by CETP or responsive to the inhibition of CETP.

2,6-Disubstituted piperiddines as modulators

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

The present invention is further directed to compounds of formula (I): wherein R1, R2, R3, R4, R5, R6, R7, R8, R9, R10, R16, R17, R18, R19, R20, R21 and R22 are as defined herein) which are modulators of chemokine receptor activity and are useful in the prevention or treatment of certain inflammatory and immunoregulatory disorders and diseases, allergic diseases, atopic conditions including allergic rhinitis, dermatitis, conjunctivitis, and asthma, as well as autoimmune pathologies such as rheumatoid arthritis and atherosclerosis. The invention is also directed to pharmaceutical compositions comprising these compounds and the use of these compounds and compositions in the prevention or treatment of such diseases in which chemokine receptors are involved.

ALKYLAMINO, ARYLAMINO, AND SULFONAMIDO CYCLOPENTYL AMIDE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY

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Page/Page column 23, (2010/11/27)

Compounds of the formula (I) which are modulators of chemokine receptor activity useful in the prevention or treatment of certain inflammatory and immunoregulatory disorders and diseases, allergic diseases, atopic conditions including allergic rhinitis, dermatitis, conjunctivitis, and asthma, as well as autoimmune pathologies such as rheumatoid arthritis and atherosclerosis, and pharmaceutical compositions comprising these compounds and the use of these compounds and compositions in the prevention or treatment of such diseases in which chemokine receptors are involved.

PYRIDINYL AMINE DERIVATIVES AS INHIBITORS OF CHOLESTERYL ESTER TRANSFER PROTEIN (CETP)

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Page/Page column 75, (2008/06/13)

The present invention relates to a compound of formula (I) or a pharmaceutically acceptable salt thereof, wherein the variables are as defined, useful as inhibitors of chlosteryl ester transfer protein.

AMINO HETEROCYCLIC MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY

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Page/Page column 43, (2010/02/13)

Compounds of Formula I and Formula II: (wherein n, R 1,R2, R3, R4, R5, R6, R7, R8, R9, R10, R15, R16, R17, R18, R19, R24, R25, R26, R27, R28, R29, R30, R33 R34, R35, R36, R37, R38, A, j, k, m, n, X, Y and Z are as defined herein) which are modulators of chemokine receptor activity and are useful in the prevention or treatment of certain inflammatory and immunoregulatory disorders and diseases, allergic diseases, atopic conditions including allergic rhinitis, dermatitis, conjunctivitis, and asthma, as well as autoimmune pathologies such as rheumatoid arthritis and atherosclerosis. The invention is also directed to pharmaceutical compositions comprising these compounds and the use of these compounds and compositions in the prevention or treatment of such diseases in which chemokine receptors are involved.

3-(4-Heteroarylcyclohexylamino)cyclopentanecarboxamides as modulators of chemokine receptors

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Page/Page column 22-23, (2010/02/14)

The present invention is directed to compounds of Formula I: which are modulators of chemokine receptors. The compounds of the invention, and compositions thereof, are useful in the treatment of diseases related to chemokine receptor expression and/or act

TETRAHYDROPYRAN HETEROCYCLIC CYCLOPENTYL HETEROARYL MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY

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Page 52, (2008/06/13)

The present invention is further directed to compounds of the formulas: (I) (II) (wherein R1, R2, R3, R4, R5, R6, R7, R8, R9, R10, R15, R16, R17, R18, R19, R24 and R25 are as defined herein) which are modulators of chemokine receptor activity and are useful in the prevention or treatment of certain inflammatory and immunoregulatory disorders and diseases, allergic diseases, atopic conditions including allergic rhinitis, dermatitis, conjunctivitis, and asthma, as well as autoimmune pathologies such as rheumatoid arthritis and atherosclerosis. The invention is also directed to pharmaceutical compositions comprising these compounds and the use of these compounds and compositions in the prevention or treatment of such diseases in which chemokine receptors are involved.

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