3-(Piperidin-1-ylsulfonyl)phenylboronic acid

Base Information

• Chemical Name: 3-(Piperidin-1-ylsulfonyl)phenylboronic acid
• CAS No.: 690662-96-5
• Molecular Formula: C11H16BNO4S
• Molecular Weight: 269.13
• Hs Code.: 2935009090
• DSSTox Substance ID: DTXSID50463828
• Wikidata: Q82288884
• Mol file: 690662-96-5.mol

Synonyms:690662-96-5;3-(PIPERIDIN-1-YLSULFONYL)PHENYLBORONIC ACID;(3-(Piperidin-1-ylsulfonyl)phenyl)boronic acid;3-(1-Piperidinylsulfonyl)phenylboronic Acid;(3-piperidin-1-ylsulfonylphenyl)boronic acid;MFCD07783850;Boronic acid, [3-(1-piperidinylsulfonyl)phenyl]-;SCHEMBL3915596;DTXSID50463828;AC6633;AKOS015854223;BS-24442;SY026552;CS-0175336;(3-(Piperidin-1-ylsulfonyl)phenyl)boronicacid;A853955;3-(piperidin-1-ylsulfonyl)phenylboronic acid, AldrichCPR;3-(piperidin-1-ylsulfonyl)phenylboronic acid

Chemical Property of 3-(Piperidin-1-ylsulfonyl)phenylboronic acid

Chemical Property:

• Melting Point: 166-168℃
• Boiling Point: 494.5±55.0 °C(Predicted)
• PKA: 7.65±0.10(Predicted)
• PSA: 86.22000
• Density: 1.37±0.1 g/cm3(Predicted)
• LogP: 0.55970
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 269.0893093
• Heavy Atom Count: 18
• Complexity: 362

Purity/Quality:

97% ^*data from raw suppliers

(3-(Piperidin-1-ylsulfonyl)phenyl)boronicacid 98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26

MSDS Files:

Useful:

• Canonical SMILES: B(C1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)(O)O