833-96-5

Basic information

• Product Name: 3-(PENTAFLUOROSULFANYL)BENZOIC ACID
• Synonyms: 3-(PENTAFLUOROSULFANYL)BENZOIC ACID;3-(PENTAFLUOROTHIO)BENZOIC ACID;RARECHEM AL BO 2280;3-Carboxyphenylsulphur pentafluoride;3-Sulfurpentafluorobenzoic acid;3-Carboxyphenylsulphur pentafluoride, 3-(Pentafluorosulphanyl)benzoic acid;3-(Pentafluorothio)benzoic acid 97%;3-(Pentafluorothio)benzoicacid97%
• CAS NO: 833-96-5
• Molecular Formula: C₇H₅F₅O₂S
• Molecular Weight: 248.17
• Product Categories: Carboxylic Acids;Phenyls & Phenyl-Het;Carboxylic Acids;Phenyls & Phenyl-Het
• Mol File: 833-96-5.mol

Chemical Properties

• Melting Point: 159-160℃
• Appearance: /
• CAS DataBase Reference: 3-(PENTAFLUOROSULFANYL)BENZOIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(PENTAFLUOROSULFANYL)BENZOIC ACID(833-96-5)
• EPA Substance Registry System: 3-(PENTAFLUOROSULFANYL)BENZOIC ACID(833-96-5)

Safety Data

• Hazard Codes: Xi
• HazardClass: TOXIC
• Hazardous Substances Data: 833-96-5(Hazardous Substances Data)

Upstream product

• 401892-80-6 3-(pentafluorosulfanyl)benzaldehyde 
• 124-38-9 carbon dioxide 
• 286947-67-9 pentafluoro(3-iodophenyl)-λ⁶-sulfane 
• 2613-26-5 3-nitrophenylsulfur pentafluoride 
• 2993-22-8 3-pentafluorosulfuraniline 
• 401892-82-8 3-(pentafluorosulfaneyl)benzonitrile 

Downstream Products

• 1448317-05-2 N-{4-methyl-3-[6-(1,3-thiazol-5-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-3-(pentafluoro-λ⁶-sulphanyl)benzamide 
• 1448316-16-2 N-{2-hydroxy-3-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-3-(pentafluoro-λ⁶-sulphanyl)benzamide 
• 1448316-29-7 N-{4-chloro-3-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-3-(pentafluoro-λ⁶-sulphanyl)benzamide 
• 1448316-45-7 N-{2,4-dimethyl-5-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-3-(methoxymethyl)-5-(pentafluoro-λ⁶-sulphanyl)benzamide 
• 1448316-43-5 3-({2,4-dimethyl-5-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}carbamoyl)-5-(penta-fluoro-λ⁶-sulphanyl)benzoic acid 
• 1448316-23-1 3-bromo-N-{4-methyl-3-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-5-(pentafluoro-λ⁶-sulphanyl)benzamide 
• 1448316-17-3 3-cyano-N-{2-hydroxy-3-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-5-(pentafluoro-λ⁶-sulphanyl)benzamide 
• 1448316-14-0 3-cyano-N-{2-methyl-3-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-5-(pentafluoro-λ⁶-sulphanyl)benzamide 
• 1448316-11-7 3-cyano-N-{2-methyl-5-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-3-(pentafluoro-λ⁶-sulphanyl)benzamide 
• 1448315-68-1 N-{4-methyl-3-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-3-(pentafluoro-λ⁶-sulphanyl)-5-(piperazin-1-ylmethyl)benzamide 
• 1448315-61-4 3-cyano-N-{4-methyl-3-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-5-(pentafluoro-λ⁶-sulphanyl)benzamide 
• 1448315-62-5 N-{4-methyl-3-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-5-(pentafluoro-λ⁶-sulphanyl)isophthalamide 
• 1448315-59-0 N-{4-methyl-3-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-3-(methylsulphonyl)-5-(pentafluoro-λ⁶-sulphanyl)benzamide 
• 1448315-58-9 N-{4-methyl-3-[6-(pyridin-3-yl)-1H-imidazo[1,2-b]pyrazol-1-yl]phenyl}-3-(pentafluoro-λ⁶-sulphanyl)-5-(pyrrolidin-3-yloxy)benzamide 

Relevant articles and documents

Ir-catalyzed preparation of SF5-substituted potassium aryl trifluoroborates via C-H borylation and their application in the Suzuki-Miyaura reaction

The preparation of new pentafluorosulfanyl-substituted potassium aryltrifluoroborates via Ir-catalyzed C-H borylation is reported. The utility of these novel building blocks was demonstrated in the Suzuki-Miyaura cross-coupling reaction, giving access to

Synthesis and characterisation of 3- and 4-(pentafluorosulfanyl)benzoic acid derivatives. X-ray structure of 3-SF5-C6H4-COOH

The high yield synthesis of 3- and 4-(pentafluorosulfanyl)benzoic acid derivatives is described starting from the NO2-derivatives, which are reduced to the corresponding anilines. Then the NH2- group is converted to bromide and subsequently to the HC{double bond, long}O moiety. The benzaldeydes are then oxidised to the corresponding benzoic acids. The X-ray structure of 3-SF5-C6H4-COOH is also reported.

ORTHO-SUBSTITUTED PENTAFLUORIDE SULFANYL-BENZENES, METHOD FOR THE PRODUCTION THEREOF AND THE USE THEREOF IN THE FORM OF VALUABLE SYNTHESIS INTERMEDIATE STAGES

The invention relates to pentafluoride-sulfanyl-benzenes of formula (I), wherein groups from R1 to R5 correspond to meanings given in claims and constitute valuable intermediates, for example for producing drugs, diagnosis agents, liquid crystals, polymers, herbicides, fungicidals, nematicidals, parasiticides, insecticides, acaricides and arthropodicides.