3-Allylaminocarbonylphenylboronic acid

Base Information

• Chemical Name: 3-Allylaminocarbonylphenylboronic acid
• CAS No.: 850567-29-2
• Molecular Formula: C10H12BNO3
• Molecular Weight: 205.02
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID90393130
• Wikidata: Q82191767
• Mol file: 850567-29-2.mol

Synonyms:850567-29-2;3-Allylaminocarbonylphenylboronic acid;(3-(Allylcarbamoyl)phenyl)boronic acid;[3-(prop-2-enylcarbamoyl)phenyl]boronic Acid;(3-Allylaminocarbonyl)phenylboronic acid;(3-ALLYLAMINOCARBONYL)BENZENEBORONIC ACID;{3-[(prop-2-en-1-yl)carbamoyl]phenyl}boronic acid;LITHIUMAZIDE;(3-(Allylcarbamoyl)phenyl)boronicacid;3-(Allylaminocarbonyl)benzeneboronic acid;DTXSID90393130;3-(allylcarbamoyl)phenylboronic acid;MFCD04115702;AKOS015839111;AB20437;BP-10193;BS-22336;CS-0174297;FT-0694244;H11840;(3-allylaminocarbonyl)benzeneboronic acid, AldrichCPR

Chemical Property of 3-Allylaminocarbonylphenylboronic acid

Chemical Property:

• Melting Point: 92-96 ºC
• Refractive Index: 1.553
• PKA: 7.85±0.10(Predicted)
• PSA: 69.56000
• Density: 1.18 g/cm³
• LogP: -0.32690
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 205.0910234
• Heavy Atom Count: 15
• Complexity: 233

Purity/Quality:

98%min ^*data from raw suppliers

3-Allylaminocarbonylphenylboronicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

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