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2-(Chloromethyl)-5-(trifluoromethyl)pyridine is a synthetic chemical compound that belongs to the pyridine family. It has the molecular formula C7H5ClF3N and is primarily characterized by its trifluoromethyl and chloromethyl functional groups. 2-(CHLOROMETHYL)-5-(TRIFLUOROMETHYL)PYRIDINE is known for its reactivity, particularly due to the chloromethyl group, which allows it to participate in substitution reactions. As a result, it is considered a promising intermediate for the synthesis of complex molecules in various industries, including pharmaceuticals.

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  • 128790-14-7 Structure
  • Basic information

    1. Product Name: 2-(CHLOROMETHYL)-5-(TRIFLUOROMETHYL)PYRIDINE
    2. Synonyms: 2-(CHLOROMETHYL)-5-(TRIFLUOROMETHYL)PYRIDINE;2-(ChloroMethyl)-5-(trifluoroMethoxy)pyridine;5-trifluoroMethyl-pyridin-2-ylMethyl chloride
    3. CAS NO:128790-14-7
    4. Molecular Formula: C7H5ClF3N
    5. Molecular Weight: 195.57
    6. EINECS: 604-604-1
    7. Product Categories: N/A
    8. Mol File: 128790-14-7.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 198.1°C at 760 mmHg
    3. Flash Point: 73.6°C
    4. Appearance: /
    5. Density: 1.359g/cm3
    6. Vapor Pressure: 0.515mmHg at 25°C
    7. Refractive Index: 1.455
    8. Storage Temp.: 2-8°C
    9. Solubility: N/A
    10. CAS DataBase Reference: 2-(CHLOROMETHYL)-5-(TRIFLUOROMETHYL)PYRIDINE(CAS DataBase Reference)
    11. NIST Chemistry Reference: 2-(CHLOROMETHYL)-5-(TRIFLUOROMETHYL)PYRIDINE(128790-14-7)
    12. EPA Substance Registry System: 2-(CHLOROMETHYL)-5-(TRIFLUOROMETHYL)PYRIDINE(128790-14-7)
  • 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: 128790-14-7(Hazardous Substances Data)

128790-14-7 Usage

Uses

Used in Pharmaceutical Industry:
2-(Chloromethyl)-5-(trifluoromethyl)pyridine is used as a chemical intermediate for the synthesis of complex molecules. Its reactivity, particularly the chloromethyl group, enables it to be involved in substitution reactions, which is crucial for creating new compounds with potential therapeutic applications.
Used in Chemical Industry:
2-(Chloromethyl)-5-(trifluoromethyl)pyridine is used as a building block in the synthesis of various chemical compounds. Its unique structure and functional groups make it a valuable component in the development of new materials and products, such as agrochemicals, dyes, and other specialty chemicals. 2-(CHLOROMETHYL)-5-(TRIFLUOROMETHYL)PYRIDINE's versatility in chemical reactions allows for the creation of a wide range of derivatives with different properties and applications.

Check Digit Verification of cas no

The CAS Registry Mumber 128790-14-7 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,2,8,7,9 and 0 respectively; the second part has 2 digits, 1 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 128790-14:
(8*1)+(7*2)+(6*8)+(5*7)+(4*9)+(3*0)+(2*1)+(1*4)=147
147 % 10 = 7
So 128790-14-7 is a valid CAS Registry Number.
InChI:InChI=1/C7H5ClF3N/c8-3-6-2-1-5(4-12-6)7(9,10)11/h1-2,4H,3H2

128790-14-7SDS

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 2-(Chloromethyl)-5-(trifluoromethyl)pyridine

1.2 Other means of identification

Product number -
Other names 5-trifluoromethyl-pyridin-2-ylmethyl chloride

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:128790-14-7 SDS

128790-14-7Relevant articles and documents

TEAD INHIBITORS AND USES THEREOF

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Paragraph 00465; 00808, (2020/12/11)

The present invention provides compounds, compositions thereof, and methods of using the same.

Synthesis and structure-activity relationships of varied ether linker analogues of the antitubercular drug (6 S)-2-nitro-6-{[4-(trifluoromethoxy) benzyl]oxy}-6,7-dihydro-5 H -imidazo[2,1- b ][1,3]oxazine (PA-824)

Thompson, Andrew M.,Sutherland, Hamish S.,Palmer, Brian D.,Kmentova, Iveta,Blaser, Adrian,Franzblau, Scott G.,Wan, Baojie,Wang, Yuehong,Ma, Zhenkun,Denny, William A.

, p. 6563 - 6585 (2011/12/02)

New analogues of antitubercular drug PA-824 were synthesized, featuring alternative side chain ether linkers of varying size and flexibility, seeking drug candidates with enhanced metabolic stability and high efficacy. Both α-methyl substitution and removal of the benzylic methylene were broadly tolerated in vitro, with a biaryl example of the latter class exhibiting an 8-fold better efficacy than the parent drug in a mouse model of acute Mycobacterium tuberculosis infection and negligible fragmentation to an alcohol metabolite in liver microsomes. Extended linkers (notably propenyloxy, propynyloxy, and pentynyloxy) provided greater potencies against replicating M. tb (monoaryl analogues), with propynyl ethers being most effective under anaerobic (nonreplicating) conditions (mono/biaryl analogues). For benzyloxybenzyl and biaryl derivatives, aerobic activity was maximal with the original (OCH2) linker. One propynyloxy-linked compound displayed an 89-fold higher efficacy than the parent drug in the acute model, and it was slightly superior to antitubercular drug OPC-67683 in a chronic infection model.

A series of non-quinoline cysLT1 receptor antagonists: SAR study on pyridyl analogs of Singulair

Guay, Daniel,Gauthier,Dufresne,Jones,McAuliffe,McFarlane,Metters,Prasit,Rochette,Roy,Sawyer,Zamboni

, p. 453 - 458 (2007/10/03)

The structure-activity relationship of a series of styrylpyridine analogs of MK-0476 (montelukast, Singular) is described. This work has led to the identification of a number of potent and orally active cysLT1 receptor (LTD4 receptor) antagonists including 2ab (L-733,321) as an optimized candidate.

AZOLE DERIVATIVES

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, (2008/06/13)

Azole derivatives of the formulas R1-CR2R3-CHR4-CR5R6-R7 are described; wherein R1 is a heterocyclyl radicla selected from 1,2,4-triazolyl, optionally-substituted imidazolyl, pyridyl and pyrimidinyl radicals; R2 and R3, which may be the same or differen

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