(4-((Benzyloxy)carbonyl)-2-nitrophenyl)boronic acid

Base Information

• Chemical Name: (4-((Benzyloxy)carbonyl)-2-nitrophenyl)boronic acid
• CAS No.: 850568-58-0
• Molecular Formula: C14H12BNO6
• Molecular Weight: 301.06
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID10397473
• Wikidata: Q82198850
• Mol file: 850568-58-0.mol

Synonyms:850568-58-0;(4-Benzyloxycarbonyl-2-nitro)phenylboronic acid;(4-((Benzyloxy)carbonyl)-2-nitrophenyl)boronic acid;(4-BENZYLOXYCARBONYL-2-NITRO)BENZENEBORONIC ACID;(2-nitro-4-phenylmethoxycarbonylphenyl)boronic acid;{4-[(benzyloxy)carbonyl]-2-nitrophenyl}boronic acid;4-(Benzyloxycarbonyl)-2-nitrobenzeneboronic acid;DTXSID10397473;MFCD02179461;AKOS015893891;AB11182;BS-24169;CS-0175265;FT-0644945;4-(benzyloxycarbonyl)-2-nitrophenylboronic acid;A841124;(4-((Benzyloxy)carbonyl)-2-nitrophenyl)boronicacid

Chemical Property of (4-((Benzyloxy)carbonyl)-2-nitrophenyl)boronic acid

Chemical Property:

• Vapor Pressure: 3.34E-12mmHg at 25°C
• Melting Point: 192-200 °C
• Refractive Index: 1.618
• Boiling Point: 533.3 °C at 760 mmHg
• PKA: 7.29±0.53(Predicted)
• Flash Point: 276.3 °C
• PSA: 112.58000
• Density: 1.4 g/cm³
• LogP: 1.15480
• Storage Temp.: Keep Cold
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 301.0757673
• Heavy Atom Count: 22
• Complexity: 393

Purity/Quality:

98%min ^*data from raw suppliers

(4-Benzyloxycarbonyl-2-nitro)phenylboronicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)[N+](=O)[O-])(O)O