2,4-Difluoro-5-nitrophenylboronic acid

Base Information

• Chemical Name: 2,4-Difluoro-5-nitrophenylboronic acid
• CAS No.: 325786-11-6
• Molecular Formula: C₆H₄BF₂NO₄
• Molecular Weight: 202.91
• Hs Code.: 2931900090
• European Community (EC) Number: 802-171-4
• DSSTox Substance ID: DTXSID50396445
• Wikidata: Q82197165
• ChEMBL ID: CHEMBL5186664
• Mol file: 325786-11-6.mol

Synonyms:325786-11-6;2,4-DIFLUORO-5-NITROPHENYLBORONIC ACID;(2,4-difluoro-5-nitrophenyl)boronic acid;2,4-DIFLUORO-5-NITROBENZENEBORONIC ACID;(2,4-difluoro-5-nitro-phenyl)boronic Acid;SCHEMBL6719166;CHEMBL5186664;DTXSID50396445;PSPLUVTUISDWMW-UHFFFAOYSA-N;MFCD03095253;2,4-Difluoro-5-nitrophenylboronicacid;AKOS015853388;AB13615;PS-9402;(2,4-difluoro-5-nitrophenyl)boronicacid;FT-0644421;A821327

Chemical Property of 2,4-Difluoro-5-nitrophenylboronic acid

Chemical Property:

• Vapor Pressure: 7.46E-06mmHg at 25°C
• Melting Point: 225-227 °C
• Refractive Index: 1.526
• Boiling Point: 361.4 °C at 760 mmHg
• PKA: 6.81±0.58(Predicted)
• Flash Point: 172.3 °C
• PSA: 86.28000
• Density: 1.57 g/cm³
• LogP: 0.07600
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 203.0201441
• Heavy Atom Count: 14
• Complexity: 224

Purity/Quality:

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

2,4-Difluoro-5-nitrophenylboronicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC(=C(C=C1F)F)[N+](=O)[O-])(O)O