207974-17-2

Basic information

• Product Name: 2,6-DIFLUOROPHENYL ISOTHIOCYANATE
• Synonyms: 2,6-DIFLUOROPHENYL ISOTHIOCYANATE;Benzene, 1,3-difluoro-2-isothiocyanato- (9CI);2,6-Difluorophenyl isothiocyanate 97%;2,6-Difluorophenylisothiocyanate97%;Benzene-1,3-difluoro-2-isothiocyanato;2,6-Difluorophenyl isothiocyanate,98%;2,6-Difluorophenyl isothiocyate
• CAS NO: 207974-17-2
• Molecular Formula: C₇H₃F₂NS
• Molecular Weight: 171.17
• EINECS: -0
• Product Categories: ISOTHIOCYANATE;Phenyl isocyanate&Phenyl isothiocyanate;Organic Building Blocks;Sulfur Compounds;Thiocyanates/Isothiocyanates;Fluorine series
• Mol File: 207974-17-2.mol

Chemical Properties

• Boiling Point: 217 °C(lit.)
• Flash Point: 220 °F
• Appearance: /
• Density: 1.325 g/mL at 25 °C(lit.)
• Vapor Pressure: 1.21mmHg at 25°C
• Refractive Index: n20/D 1.604(lit.)
• Storage Temp.: 2-8°C
• Water Solubility: Hydrolyzes in water.
• Sensitive: Moisture Sensitive
• BRN: 2090586
• CAS DataBase Reference: 2,6-DIFLUOROPHENYL ISOTHIOCYANATE(CAS DataBase Reference)
• NIST Chemistry Reference: 2,6-DIFLUOROPHENYL ISOTHIOCYANATE(207974-17-2)
• EPA Substance Registry System: 2,6-DIFLUOROPHENYL ISOTHIOCYANATE(207974-17-2)

Safety Data

• Hazard Codes: C,T
• Statements: 34-42
• Safety Statements: 26-27-36/37/39-45
• RIDADR: UN 1760 8/PG 2
• WGK Germany: 3
• HazardClass: 6.1
• PackingGroup: II
• Hazardous Substances Data: 207974-17-2(Hazardous Substances Data)

Usage

Uses

Used in Chemical Industry:
2,6-Difluorophenyl isothiocyanate is used as a chemical intermediate for the synthesis of various organic compounds. Its reactivity and functional groups make it a valuable building block in the development of new chemical products.
Used in Organic Chemistry:
In organic chemistry, 2,6-difluorophenyl isothiocyanate is utilized as a reagent for the formation of various organic compounds. Its ability to undergo acylation reactions with other molecules allows for the creation of new organic structures with potential applications in various fields.
Used in Pharmaceutical Industry:
2,6-Difluorophenyl isothiocyanate is used as a pharmaceutical intermediate, playing a crucial role in the synthesis of various pharmaceutical compounds. Its unique chemical properties enable the development of new drugs with potential therapeutic benefits.
For example, 1H-[1,2,4]triazole-3,5-diamine undergoes acylation with 2,6-difluorophenyl isothiocyanate to form the corresponding 1-acyl-1H-[1,2,4]triazole-3,5-diamine, which can be further used in the development of pharmaceutical products.

InChI:InChI=1/C7H3F2NO/c8-5-2-1-3-6(9)7(5)10-4-11/h1-3H

Upstream product

• 5509-65-9 2,6-difluoroaniline 
• 16420-13-6 N,N-Dimethylthiocarbamoyl chloride 
• 463-71-8 thiophosgene 

Downstream Products

• 65295-73-0 1-(2-aminoethyl)-3-(2,6-difluorophenyl)-thiourea 
• 1027266-81-4 1-(8-amino-4,4-dimethyl-1,3-dioxo-1,2,3,4-tetrahydro-isoquinolin-7-yl)-3-(2,6-difluoro-phenyl)-thiourea 
• 443798-55-8 3-amino-5-(4-sulfamoyl-phenylamino)-[1,2,4]triazole-1-carbothioic acid (2,6-difluoro-phenyl)-amide 
• 443798-47-8 CDK₁/2 inhibitor III 
• 82401-32-9 1-(benzyloxy)-3-(2,6-difluorophenyl)-1-(2-phthalimidoethyl)-2-thiourea 
• 1039819-74-3 3-(2,6-difluorophenyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline 
• 1033590-93-0 C₁₄H₁₂F₂N₂OS 
• 1152594-70-1 O-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl] 2,6-difluorophenylthiocarbamate 
• 1152595-59-9 2-({[2-({[(2,6-difluorophenyl)amino]carbonothioyl}oxy)ethyl]amino}carbonyl)benzoic acid 
• 1192304-27-0 2'-O,3'-N-(carbonimidoyl)-3'-N-demethyl-N'-(2,6-difluorophenyl)-6-O-methyl-9a-aza-9a-homoerythromycin A 
• 851749-68-3 sodium 3-cyano-1-(2, 6-difluorophenyl)-6-oxo-1,6-dihydropyridine-2-thiolate 
• 1207371-60-5 C₁₄H₁₁F₂N₃O₂S 
• 1357082-28-0 8-chloro-3-(2,6-difluorophenyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline 
• 1384973-07-2 5-(2,6-difluorophenyl)-6-thioxo-6,7-dihydro-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one 

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