4-(4-Oxopiperidine-1-carbonyl)phenylboronic acid

Base Information

• Chemical Name: 4-(4-Oxopiperidine-1-carbonyl)phenylboronic acid
• CAS No.: 850568-23-9
• Molecular Formula: C12H14BNO4
• Molecular Weight: 247.05
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID90394920
• Wikidata: Q82194626
• Mol file: 850568-23-9.mol

Synonyms:850568-23-9;4-(4-Oxopiperidine-1-carbonyl)phenylboronic acid;4-(4-Oxopiperidin-1-ylcarbonyl)benzeneboronic acid;(4-(4-Oxopiperidine-1-carbonyl)phenyl)boronic acid;[4-(4-oxopiperidine-1-carbonyl)phenyl]boronic Acid;4-[(4-Oxopiperidin-1-yl)carbonyl]benzeneboronic acid;C12H14BNO4;H-D-Asp-OtBuHCl;SCHEMBL1490905;DTXSID90394920;MFCD04115679;AKOS015855353;AB20375;PS-9547;CS-0174612;F87529;EN300-7390246;(4-(4-Oxopiperidine-1-carbonyl)phenyl)boronicacid;A863757;Z2725641887

Chemical Property of 4-(4-Oxopiperidine-1-carbonyl)phenylboronic acid

Chemical Property:

• Melting Point: 156-160 °C
• Boiling Point: 515.2 °C at 760 mmHg
• Flash Point: 265.4 °C
• PSA: 77.84000
• Density: 1.32 g/cm³
• LogP: -0.89060
• Storage Temp.: Keep Cold
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 247.1015881
• Heavy Atom Count: 18
• Complexity: 316

Purity/Quality:

98%min ^*data from raw suppliers

B-[4-[(4-Oxo-1-piperidinyl)carbonyl]phenyl]boronicAcid ^*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)N2CCC(=O)CC2)(O)O
• Uses: B-[4-[(4-Oxo-1-piperidinyl)carbonyl]phenyl]boronic Acid can be used as reactant/reagent in preparation of 6,11-dihydro-5H-benzo[d]imidazo[1,2-a]azepines derivatives as histamine H4 receptor ligands for therapy.