3-Fluoro-4-isopropoxyphenylboronic acid

Base Information

• Chemical Name: 3-Fluoro-4-isopropoxyphenylboronic acid
• CAS No.: 480438-54-8
• Molecular Formula: C9H12 B F O3
• Molecular Weight: 198.002
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID40584278
• Wikidata: Q82475909
• Mol file: 480438-54-8.mol

Synonyms:3-Fluoro-4-isopropoxyphenylboronic acid;480438-54-8;3-FLUORO-4-ISOPROPOXYPHENYLBORONICACID;(3-fluoro-4-propan-2-yloxyphenyl)boronic acid;Boronic acid, B-[3-fluoro-4-(1-methylethoxy)phenyl]-;[3-FLUORO-4-(PROPAN-2-YLOXY)PHENYL]BORONIC ACID;MFCD05865163;(3-fluoro-4-isopropoxyphenyl)boronic acid;[3-Fluoro-4-(1-methylethoxy)phenyl]boronic acid;Boronic acid, [3-fluoro-4-(1-methylethoxy)phenyl]-;(3-Fluoro-4-isopropoxy-phenyl)boronic acid;SCHEMBL9258;DTXSID40584278;XZQQJUVWZYJYPN-UHFFFAOYSA-N;AKOS004114104;AB22947;AS-55787;SY110358;CS-0154165;3-fluoro-4-(1-methyl-ethoxy)phenylboronic acid;EN300-1726183;{3-Fluoro-4-[(propan-2-yl)oxy]phenyl}boronic acid

Chemical Property of 3-Fluoro-4-isopropoxyphenylboronic acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 112-117oC(lit.)
• Boiling Point: 331.693oC at 760 mmHg
• PKA: 7.69±0.18(Predicted)
• Flash Point: 154.403oC
• PSA: 49.69000
• Density: 1.18g/cm3
• LogP: 0.29270
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 198.0863526
• Heavy Atom Count: 14
• Complexity: 177

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-Fluoro-4-isopropoxyphenylboronicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: B(C1=CC(=C(C=C1)OC(C)C)F)(O)O
• Uses: Reactant involved in:Synthesis of azaxanthene based selective glucocorticoid receptor modulatorsSuzuki and Stille coupling for synthesis of oral venous antithrombotic drugs