4-(Furfurylaminocarbonyl)phenylboronic acid

Base Information

• Chemical Name: 4-(Furfurylaminocarbonyl)phenylboronic acid
• CAS No.: 850568-18-2
• Molecular Formula: C12H12BNO4
• Molecular Weight: 245.043
• Hs Code.: 2932190090
• DSSTox Substance ID: DTXSID10407228
• Wikidata: Q82212475
• Mol file: 850568-18-2.mol

Synonyms:850568-18-2;4-(Furfurylaminocarbonyl)phenylboronic acid;(4-((Furan-2-ylmethyl)carbamoyl)phenyl)boronic acid;[4-(furan-2-ylmethylcarbamoyl)phenyl]boronic acid;{4-[(furan-2-ylmethyl)carbamoyl]phenyl}boronic acid;4-[(Fur-2-ylmethyl)carbamoyl]benzeneboronic acid;4-(Furfurylaminocarbonyl)benzeneboronic acid;SCHEMBL2933285;DTXSID10407228;KXSMENBYQORPAK-UHFFFAOYSA-N;MFCD04115672;AKOS015839458;AB20366;AM87247;PS-9583;CS-0174625;FT-0724776;[4-(furfurylaminocarbonyl)phenyl]boronic acid;4-(furan-2-ylmethylcarbamoyl)phenylboronic acid;I12493;4-(FURFURYLAMINOCARBONYL)PHENYLBORONICACID;A853725;(4-((Furan-2-ylmethyl)carbamoyl)phenyl)boronicacid;(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)boronic acid

Chemical Property of 4-(Furfurylaminocarbonyl)phenylboronic acid

Chemical Property:

• Melting Point: 134-140 °C
• Refractive Index: 1.595
• PKA: 8.09±0.16(Predicted)
• PSA: 82.70000
• Density: 1.31 g/cm³
• LogP: 0.28030
• Storage Temp.: Keep Cold
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 245.0859380
• Heavy Atom Count: 18
• Complexity: 279

Purity/Quality:

98%min ^*data from raw suppliers

4-(Furfurylaminocarbonyl)phenylboronicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC=C(C=C1)C(=O)NCC2=CC=CO2)(O)O