(3-Ethoxycarbonyl-5-nitrophenyl)boronic acid

Base Information

• Chemical Name: (3-Ethoxycarbonyl-5-nitrophenyl)boronic acid
• CAS No.: 850568-37-5
• Molecular Formula: C9H10BNO6
• Molecular Weight: 238.992
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID40378437
• Wikidata: Q82167935
• Mol file: 850568-37-5.mol

Synonyms:850568-37-5;(3-ethoxycarbonyl-5-nitrophenyl)boronic acid;3-ETHOXYCARBONYL-5-NITROPHENYLBORONIC ACID;3-(Ethoxycarbonyl)-5-nitrobenzeneboronic acid;(3-(ethoxycarbonyl)-5-nitrophenyl)boronic acid;[3-(ethoxycarbonyl)-5-nitrophenyl]boronic acid;(3-Ethoxycarbonyl-5-nitrophenyl)boronicacid;3-(ethoxycarbonyl)-5-nitrophenylboronic acid;(3-ethoxycarbonyl-5-nitro-phenyl)boronic Acid;SCHEMBL6651446;DTXSID40378437;STR08853;MFCD03788422;AKOS015838799;AB15995;CS-W012832;FT-0644934;W16747;A841113;J-512413

Chemical Property of (3-Ethoxycarbonyl-5-nitrophenyl)boronic acid

Chemical Property:

• Vapor Pressure: 7.13E-09mmHg at 25°C
• Melting Point: 158-163 °C
• Refractive Index: 1.556
• Boiling Point: 449.7 °C at 760 mmHg
• Flash Point: 225.8 °C
• PSA: 112.58000
• Density: 1.39 g/cm³
• LogP: -0.02550
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 239.0601172
• Heavy Atom Count: 17
• Complexity: 292

Purity/Quality:

99% ^*data from raw suppliers

3-Ethoxycarbonyl-5-nitrophenylboronicacid ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC)(O)O
• Uses: suzuki reaction 3-Ethoxycarbonyl-5-nitrophenylboronic acid