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CAS

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136547-20-1

4-trifluoromethyl-2-methylthio-pyrimidine is a specific chemical compound derived from pyrimidine, a heterocyclic organic molecule. It is characterized by the presence of a trifluoromethyl group and a methylthio group, which are both important for its chemical and biological properties. 4-trifluoromethyl-2-methylthio-pyrimidine has shown potential in various applications, including pharmaceuticals and agrochemicals, due to its unique structural features that may confer biological activity, such as antiviral or antibacterial properties.

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  • 136547-20-1 Structure

  • Basic information

    1. Product Name: 4-trifluoromethyl-2-methylthio-pyrimidine
    2. Synonyms: 4-trifluoromethyl-2-methylthio-pyrimidine
    3. CAS NO:136547-20-1
    4. Molecular Formula: C6H5F3N2S
    5. Molecular Weight: 194.18
    6. EINECS: -0
    7. Product Categories: N/A
    8. Mol File: 136547-20-1.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 225.6 °C at 760 mmHg
    3. Flash Point: 90.2 °C
    4. Appearance: /
    5. Density: 1.4 g/cm3
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: 4-trifluoromethyl-2-methylthio-pyrimidine(CAS DataBase Reference)
    10. NIST Chemistry Reference: 4-trifluoromethyl-2-methylthio-pyrimidine(136547-20-1)
    11. EPA Substance Registry System: 4-trifluoromethyl-2-methylthio-pyrimidine(136547-20-1)

  • 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: 136547-20-1(Hazardous Substances Data)

136547-20-1 Usage

Uses

Used in Pharmaceutical Industry:
4-trifluoromethyl-2-methylthio-pyrimidine is used as a pharmaceutical agent for its potential antiviral or antibacterial activity. Its structural features allow it to interact with biological targets, offering a promising avenue for the development of new therapeutics to combat viral and bacterial infections.
Used in Agrochemical Industry:
In the agrochemical sector, 4-trifluoromethyl-2-methylthio-pyrimidine is used as a bioactive compound for its potential to control or prevent the growth of harmful microorganisms in agricultural settings. This can contribute to crop protection and enhancement of agricultural productivity.
Used as a Precursor in Organic Synthesis:
4-trifluoromethyl-2-methylthio-pyrimidine serves as a precursor or intermediate in the synthesis of more complex organic compounds. Its unique functional groups make it a valuable building block for further research and development in the creation of novel molecules with specific applications in various fields.

Check Digit Verification of cas no

The CAS Registry Mumber 136547-20-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,3,6,5,4 and 7 respectively; the second part has 2 digits, 2 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 136547-20:
(8*1)+(7*3)+(6*6)+(5*5)+(4*4)+(3*7)+(2*2)+(1*0)=131
131 % 10 = 1
So 136547-20-1 is a valid CAS Registry Number.

136547-20-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-methylsulfanyl-4-(trifluoromethyl)pyrimidine

1.2 Other means of identification

Product number -
Other names 4-trifluoromethyl-2-methylthiopyrimidine

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:136547-20-1 SDS

136547-20-1Relevant articles and documents

Triphenylethanamine Derivatives as Cholesteryl Ester Transfer Protein Inhibitors: Discovery of N-[(1R)-1-(3-Cyclopropoxy-4-fluorophenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-phenylethyl]-4-fluoro-3-(trifluoromethyl)benzamide (BMS-795311)

Qiao, Jennifer X.,Wang, Tammy C.,Adam, Leonard P.,Chen, Alice Ye A.,Taylor, David S.,Yang, Richard Z.,Zhuang, Shaobin,Sleph, Paul G.,Li, Julia P.,Li, Danshi,Yin, Xiaohong,Chang, Ming,Chen, Xue-Qing,Shen, Hong,Li, Jianqing,Smith, Daniel,Wu, Dauh-Rurng,Leith, Leslie,Harikrishnan, Lalgudi S.,Kamau, Muthoni G.,Miller, Michael M.,Bilder, Donna,Rampulla, Richard,Li, Yi-Xin,Xu, Carrie,Lawrence, R. Michael,Poss, Michael A.,Levesque, Paul,Gordon, David A.,Huang, Christine S.,Finlay, Heather J.,Wexler, Ruth R.,Salvati, Mark E.

, p. 9010 - 9026 (2015)

Cholesteryl ester transfer protein (CETP) inhibitors raise HDL-C in animals and humans and may be antiatherosclerotic by enhancing reverse cholesterol transport (RCT). In this article, we describe the lead optimization efforts resulting in the discovery o

Synthesis and Metalation of Trifluoromethylpyrimidines. Metalation of Diazines. XVI

Ple, N.,Turck, A.,Heynderickx, A.,Queguiner, G.

, p. 551 - 556 (2007/10/03)

A new route to trifluoromethylpyrimidines is described.Lithiation of trifluoromethylpyrimidines was successfully achieved and was used to synthesize new pyrimidine derivatives.A new synthetic route to a biologically active molecule with antimycotic activi

Haloacetylated Enol Ethers: 4. Synthesis of 4-Trihalomethyl-2-methylthiopyrimidines

Madruga, Claudia da C.,Clerici, Edflia,Martins, Marcos A. P.,Zanatta, Nilo

, p. 735 - 738 (2007/10/02)

The synthesis of a series of 5- and 6-substituted 4-trihalomethyl-2-methylthiopyrimidines, prepared from the cyclocondensation reaction of β-alkoxyvinyl trichloromethyl ketones with 2-methyl-2-thiopseudourea sulfate, are reported.A systematic study to find the best reation conditions werre carried out.

Synthesis, antiviral (HSV-1) and antimycotic activities of ethyl or methyl 2,4-disubstituted 5-pyrimidinecarboxylates, 2,4-disubstituted 5-pyrimidinecarboxylic acids and 2,4-disubstituted pyrimidines

Sansebastiano,Mosti,Menozzi,Schenone,Muratore,Petta,Debbia,Pesce Schito,Schito

, p. 335 - 355 (2007/10/02)

The synthesis of ethyl or methyl 4-substituted or unsubstituted 2-methylthio-5-pyrimidinecarboxylates 3 a-i and 8 o mainly by reaction of ethyl or methyl 2-dimethylaminomethylene-3-oxoalkanoates with 2-methylisothiourea is described. Also some ethyl 2-sub

4-TRIFLUOROMETHYLPYRIMIDINES

Gerus, I. I.,Vdovenko, S. I.,Gorbunova, M. G.,Kukhar', V. P.

, p. 398 - 406 (2007/10/02)

It is shown that β-alkoxyvinyl trifluoromethyl ketones are convenient reagents for the synthesis of 4-trifluoromethylpyrimidines that contain a hydrogen atom or hydroxy, mercapto, and amino groups in the 2 position.The NMR, IR, and UV spectra of the synth

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