2,3,5-Trifluorophenylboronic acid

Base Information

• Chemical Name: 2,3,5-Trifluorophenylboronic acid
• CAS No.: 247564-73-4
• Molecular Formula: C₆H₄BF₃O₂
• Molecular Weight: 175.903
• Hs Code.: 2931900090
• European Community (EC) Number: 805-914-0
• DSSTox Substance ID: DTXSID20399100
• Nikkaji Number: J3.298.776A
• Wikidata: Q72513240
• Mol file: 247564-73-4.mol

Synonyms:2,3,5-Trifluorophenylboronic acid;247564-73-4;(2,3,5-trifluorophenyl)boronic Acid;2,3,5-Trifluorobenzeneboronic Acid;MFCD01863166;BORONIC ACID, B-(2,3,5-TRIFLUOROPHENYL)-;SCHEMBL1513608;DTXSID20399100;IRMUMGKQAXLGHK-UHFFFAOYSA-N;AMY13273;AKOS010057102;AC-5387;AS-32674;SY034281;2,3,5-Trifluorophenylboronic acid, >=95%;A5072;CS-0007598;FT-0644116;T2874;EN300-3169247;A877806;1-(1H-PYRAZOL-5-YL)ETHAN-1-ONEHYDROCHLORIDE

Chemical Property of 2,3,5-Trifluorophenylboronic acid

Chemical Property:

• Appearance/Colour: solid
• Melting Point: 127-132 °C(lit.)
• Boiling Point: 269.3 °C at 760 mmHg
• PKA: 6.26±0.58(Predicted)
• Flash Point: 116.7 °C
• PSA: 40.46000
• Density: 1.44 g/cm³
• LogP: -0.21630
• Storage Temp.: 2-8°C
• Solubility.: soluble in Methanol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 176.0256440
• Heavy Atom Count: 12
• Complexity: 158

Purity/Quality:

99% ^*data from raw suppliers

2,3,5-Trifluorophenylboronic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC(=CC(=C1F)F)F)(O)O
• Uses: Reactant involved in the synthesis of biologically active compounds:Pyrazole-acids to be used as agonists of human orphan GPCR GPR109aBicyclic pyrazole carboxylic acid derivatives as a niacin receptor agonist5-Alkyl and 5-aryl-pyrazole-tetrazoles as agonists of human orphan GPCR GPR109a