(3-Nitro-4-isobutylphenyl)boronic acid

Base Information

• Chemical Name: (3-Nitro-4-isobutylphenyl)boronic acid
• CAS No.: 850568-57-9
• Molecular Formula: C10H14BNO4
• Molecular Weight: 223.03
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID90397613
• Wikidata: Q82199112
• Mol file: 850568-57-9.mol

Synonyms:850568-57-9;(3-NITRO-4-ISOBUTYLPHENYL)BORONIC ACID;4-Isobutyl-3-nitrophenylboronic acid;[4-(2-methylpropyl)-3-nitrophenyl]boronic acid;4-Isobutyl-3-nitrobenzeneboronic acid;DTXSID90397613;MFCD04115653;AKOS015837573;AB20333;(4-Isobutyl-3-nitrophenyl)boronic acid;BS-24219;CS-0174824;FT-0644944;A841123;B-[4-(2-Methylpropyl)-3-nitrophenyl]boronic acid;3ALPHA-HYDROXY-2BETA-(2Z-PENTENYL)-CYCLOPENTANE-1BETA-ACETICACID

Chemical Property of (3-Nitro-4-isobutylphenyl)boronic acid

Chemical Property:

• Vapor Pressure: 3.99E-06mmHg at 25°C
• Melting Point: 168-174 °C
• Refractive Index: 1.537
• Boiling Point: 369.9 °C at 760 mmHg
• Flash Point: 177.5 °C
• PSA: 86.28000
• Density: 1.2 g/cm³
• LogP: 0.99630
• Storage Temp.: Keep Cold
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 223.1015881
• Heavy Atom Count: 16
• Complexity: 242

Purity/Quality:

97% ^*data from raw suppliers

4-Isobutyl-3-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=C1)CC(C)C)[N+](=O)[O-])(O)O