22179-72-2

Basic information

• Product Name: 4-FLUOROTHIOBENZAMIDE
• Synonyms: 4-FLUORO-1-BENZENECARBOTHIOAMIDE;4-FLUOROTHIOBENZAMIDE;BUTTPARK 62\07-42;OTAVA-BB BB7020331313;4-fluorobenzothioamide;4-Fluorothiobenzamide,99%;4-Fluorothiobenzamide 97%
• CAS NO: 22179-72-2
• Molecular Formula: C₇H₆FNS
• Molecular Weight: 155.19
• EINECS: 244-820-9
• Product Categories: Organic Building Blocks;Sulfur Compounds;Thiocarbonyl Compounds;Aryl Fluorinated Building Blocks;Building Blocks;C7;Chemical Synthesis;Fluorinated Building Blocks;Organic Building Blocks;Organic Fluorinated Building Blocks;Other Fluorinated Organic Building Blocks;Sulfur Compounds;Thiocarbonyl Compounds
• Mol File: 22179-72-2.mol
• Article Data: 39

Chemical Properties

• Melting Point: 150 °C
• Boiling Point: 239.5 °C at 760 mmHg
• Flash Point: 98.6 °C
• Appearance: light yellow solid
• Density: 1.29 g/cm₃
• Vapor Pressure: 0.04mmHg at 25°C
• Refractive Index: 1.623
• Storage Temp.: Refrigerator (+4°C)
• CAS DataBase Reference: 4-FLUOROTHIOBENZAMIDE(CAS DataBase Reference)
• NIST Chemistry Reference: 4-FLUOROTHIOBENZAMIDE(22179-72-2)
• EPA Substance Registry System: 4-FLUOROTHIOBENZAMIDE(22179-72-2)

Safety Data

• Hazard Codes: Xn,Xi
• Statements: 36/37/38-20/21/22-43-22
• Safety Statements: 36/37/39-26-22-36/37
• RIDADR: UN 3335
• HazardClass: 6.1
• Hazardous Substances Data: 22179-72-2(Hazardous Substances Data)

Usage

Chemical Properties

Yellow crystaline powder or flakes

InChI:InChI=1/C7H6FNS/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H2,9,10)

Upstream product

• 459-57-4 4-fluorobenzaldehyde 
• 403-43-0 4-fluorobenzoyl chloride 
• 456-22-4 4-Fluorobenzoic acid 
• 459-23-4 4-fluorobenzaldoxime 
• 1194-02-1 4-fluorobenzonitrile 
• 298-06-6 O,O-Diethyl hydrogen phosphorodithioate 
• 19172-47-5 Lawessons reagent 
• 824-75-9 p-fluorobenzamide 

Downstream Products

• 74466-79-8 N-[1-Dimethylamino-meth-(E)-ylidene]-4-fluoro-thiobenzamide 
• 1424328-60-8 C₈H₄FNOS₂ 
• 1126253-10-8 6-carboxy-2-(4'-fluorophenyl)-1,3-benzothiazole 
• 444615-63-8 diethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4,5-dicarboxylate 
• 937079-09-9 1-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethanone 
• 258346-48-4 2-[5-ethyl-2-(4-fluorophenyl)-1,3-thiazol-4-yl]acetic acid 
• 727382-98-1 ethyl 2-methyl-6-oxo-5-{2-[4-fluorophenyl](1,3-thiazol-4-yl)}-1,6-dihydro-3-pyridinecarboxylate 
• 303162-45-0 4-[2-(4-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-5-yl]-2-pyridylamine 
• 74466-90-3 5-(4-Fluoro-phenyl)-[1,2,4]thiadiazole 
• 85559-05-3 3-(4-Fluoro-phenyl)-isothiazole-4,5-dicarboxylic acid dimethyl ester 
• 85559-02-0 3-(4-Fluoro-phenyl)-[1,4,2]dithiazol-5-one 
• 145916-31-0 (S)-2-Amino-3-[2-(4-fluoro-phenyl)-thiazol-4-yl]-N-hydroxy-propionamide 
• 145916-35-4 (S)-2-Amino-3-[2-(4-fluoro-phenyl)-thiazol-4-yl]-propionic acid 
• 78743-11-0 3-[2-(4-Fluoro-phenyl)-thiazol-4-yl]-4-hydroxy-pyrrole-2,5-dione 

Relevant articles and documents

Substituted pyrimidine compound and application thereof

The present invention discloses a substituted pyrimidine compound, which has a structure represented by a general formula I, wherein each substituent is defined in the specification. According to thepresent invention, the compound has a broad-spectrum bactericidal activity, can provide excellent prevention and control effects on cucumber downy mildew, wheat powdery mildew, corn rust disease, riceblast, cucumber anthracnose and the like, and particularly can provide good prevention effects on powdery mildew, corn rust disease and rice blast.

Structural and Activity Relationships of 6-Sulfonyl-8-Nitrobenzothiazinones as Antitubercular Agents

The benzothiazinone (BTZ) scaffold compound PBTZ169 kills Mycobacterium tuberculosis by inhibiting the essential flavoenzyme DprE1, consequently blocking the synthesis of the cell wall component arabinans. While extraordinarily potent against M. tuberculosis with a minimum inhibitory concentration (MIC) less than 0.2 ng/mL, its low aqueous solubility and bioavailability issues need to be addressed. Here, we designed and synthesized a series of 6-methanesulfonyl substituted BTZ analogues; further exploration introduced five-member aromatic heterocycles as linkers to attach an aryl group as the side chain. Our work led to the discovery of a number of BTZ derived compounds with potent antitubercular activity. The optimized compounds 6 and 38 exhibited MIC 47 and 30 nM, respectively. Compared to PBTZ169, both compounds displayed increased aqueous solubility and higher stability in human liver microsomes. This study suggested that an alternative side-chain modification strategy could be implemented to improve the druglike properties of the BTZ-based compounds.

Mo (CO)6-assisted Pd-supported magnetic graphene oxide-catalyzed carbonylation-cyclization as an efficient way for the synthesis of 4(3H)-quinazolinones

In this paper, a novel catalyst is introduced based on the immobilization of palladium on modified magnetic graphene oxide nanoparticles. The catalyst is characterized by several methods, including transmission electron microscopy, scanning electron microscopy, X-ray fluorescence, vibrating-sample magnetometer, Fourier transform-infrared and dynamic light scattering (DLS) analysis. The activity of the catalyst was investigated in the synthesis of 4(3H)-quinazolinones via Pd-catalyzed carbonylation-cyclization of N-(2-bromoaryl) benzimidamides by Mo (CO)6. The Mo (CO)6 is used as a carbon monoxide source for performing the reaction under mild conditions. The catalyst showed good reusability, and no change in activity was observed after 10?cycles of recovery.